data_2lnh_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 2lnh _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 120.615 0.245 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.412 0.625 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 . . . . . 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.435 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.15 0.5 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.45 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 120.84 0.352 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 . . . . . 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 121.358 0.599 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.406 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.406 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 9.7 mm . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 121.101 0.477 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.411 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.411 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm . . . . . 0 CA--C 1.55 0.961 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 . . . . . 0 CA--C 1.535 0.398 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.034 0.445 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.4 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.902 0.382 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm . . . . . 0 CA--C 1.558 1.282 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 120.555 0.217 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.059 0.457 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 . . . . . 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt . . . . . 0 N--CA 1.471 0.625 0 CA-C-O 121.185 0.517 . . . . 0.0 112.084 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo . . . . . 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.427 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t . . . . . 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 121.222 0.534 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 . . . . . 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 mm . . . . . 0 CA--C 1.557 1.249 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.985 0.422 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm . . . . . 0 CA--C 1.56 1.343 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.429 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 23.2 mtmm . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.695 0.284 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 . . . . . 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.553 1.078 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 81.8 t90 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.569 0.223 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.436 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.922 0.391 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm . . . . . 0 CA--C 1.553 1.081 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.0 t90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.708 0.29 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 . . . . . 0 CA--C 1.539 0.524 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.632 0.73 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 . . . . . 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HE2' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 . . . . . 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.552 1.025 0 CA-C-O 119.509 -0.281 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.108 0.48 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 121.412 0.625 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 . . . . . 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 121.361 0.6 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.456 0.646 . . . . 0.0 112.361 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.558 1.273 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.412 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm . . . . . 0 CA--C 1.55 0.969 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo . . . . . 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.896 0.379 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.406 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' SER . . . . . 0.406 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? . . . . . 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -144.37 160.62 40.74 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.791 1.236 . . . . 0.0 112.519 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -145.11 165.98 26.71 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.81 1.644 . . . . 0.0 111.741 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -66.59 171.32 5.19 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.476 1.288 . . . . 0.0 114.476 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.26 -67.58 0.98 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.676 1.59 . . . . 0.0 112.657 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.4 -14.8 63.26 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.7 pt -142.49 -171.8 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 128.058 2.543 . . . . 0.0 109.101 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.66 -29.24 4.51 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.579 1.085 . . . . 0.0 111.624 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -57.34 -43.99 83.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.81 1.644 . . . . 0.0 113.342 170.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.56 129.33 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.614 0.766 . . . . 0.0 110.386 177.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.86 97.06 1.46 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 107.236 -2.346 . . . . 0.0 107.236 169.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -139.58 147.89 41.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.291 1.836 . . . . 0.0 110.908 170.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t -71.46 -30.09 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -33.43 75.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.046 1.338 . . . . 0.0 113.521 173.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 125.515 1.526 . . . . 0.0 113.024 177.913 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.556 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.5 t -147.69 161.0 42.08 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.265 1.826 . . . . 0.0 111.606 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -151.38 -167.13 2.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.619 1.568 . . . . 0.0 111.926 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 66.8 mtp -41.53 128.71 3.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.554 1.942 . . . . 0.0 113.596 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -71.75 152.91 42.36 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.474 1.11 . . . . 0.0 111.644 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -69.89 -45.67 67.13 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.117 0.967 . . . . 0.0 112.093 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -68.74 126.04 28.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.227 1.011 . . . . 0.0 111.999 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -137.22 166.7 23.13 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.474 1.11 . . . . 0.0 111.515 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -148.34 156.65 42.77 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 48.3 m -139.01 118.97 13.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.458 1.503 . . . . 0.0 111.292 -170.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.09 -51.41 25.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.33 -158.31 31.35 Favored Glycine 0 CA--C 1.543 1.787 0 O-C-N 121.286 -0.884 . . . . 0.0 113.297 -162.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.2 m -74.13 82.93 1.8 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.765 1.226 . . . . 0.0 112.968 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.93 -23.19 0.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 172.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 58.55 9.74 1.19 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 126.853 2.061 . . . . 0.0 115.922 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -137.71 163.99 29.95 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -141.66 153.0 44.42 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.723 1.209 . . . . 0.0 110.723 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.83 160.28 12.3 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.178 0.99 . . . . 0.0 113.17 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 62.7 mt -115.94 23.41 12.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.119 1.768 . . . . 0.0 111.742 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -58.2 166.29 1.67 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.931 0.892 . . . . 0.0 113.235 162.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.773 2.029 . . . . 0.0 114.269 -175.26 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 -61.63 -14.42 30.62 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -134.08 45.99 2.56 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.228 1.411 . . . . 0.0 113.142 -166.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 ptp -130.71 146.44 52.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.859 1.264 . . . . 0.0 112.076 176.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.19 168.57 26.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.373 1.869 . . . . 0.0 111.38 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.26 -179.03 2.7 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 172.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -126.18 174.91 8.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.106 2.563 . . . . 0.0 110.698 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm -117.0 133.42 23.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 123.934 0.894 . . . . 0.0 110.582 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -69.26 167.39 23.91 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -68.76 75.21 0.85 Allowed 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 124.786 3.658 . . . . 0.0 112.707 174.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.2 t -136.88 117.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 125.786 1.635 . . . . 0.0 108.257 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -151.76 168.93 23.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.418 1.087 . . . . 0.0 112.984 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -73.79 176.59 6.18 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.648 1.179 . . . . 0.0 112.055 168.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -131.85 125.14 31.05 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.509 1.524 . . . . 0.0 109.28 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.7 139.65 49.81 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 112.709 -172.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 70.2 m -136.4 145.43 45.31 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.488 1.115 . . . . 0.0 111.987 -175.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -61.92 156.22 58.3 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.318 1.447 . . . . 0.0 112.944 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--O 1.255 1.326 0 C-N-CA 123.796 2.997 . . . . 0.0 113.5 177.894 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -74.29 164.24 26.85 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.132 0.973 . . . . 0.0 112.7 174.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -137.47 176.11 9.0 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.057 1.743 . . . . 0.0 111.736 -178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -130.76 171.29 13.29 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.781 1.632 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -113.89 -69.31 0.87 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.748 1.619 . . . . 0.0 112.152 -175.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -70.55 -14.41 62.49 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 pt -141.61 -167.91 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.907 2.483 . . . . 0.0 109.074 -177.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.12 -10.46 40.04 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 123.809 0.719 . . . . 0.0 113.127 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -81.07 -34.24 32.84 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.524 1.93 . . . . 0.0 113.725 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.35 -29.71 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.741 1.617 . . . . 0.0 115.141 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 71.27 22.44 78.54 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.86 1.219 . . . . 0.0 115.727 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -80.49 147.05 31.05 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.895 1.348 . . . . 0.0 111.698 175.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.435 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t -69.47 -29.85 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.94 -31.14 71.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.052 1.341 . . . . 0.0 113.795 173.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.374 1.47 . . . . 0.0 113.076 -179.748 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 67.1 p 42.74 46.23 4.37 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 126.924 2.09 . . . . 0.0 115.746 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.33 161.85 35.89 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.876 1.27 . . . . 0.0 113.397 -177.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 3.5 ptm -68.68 172.82 5.8 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.605 1.962 . . . . 0.0 113.751 171.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? 59.11 14.84 3.7 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 126.771 2.028 . . . . 0.0 115.04 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -97.36 -23.83 15.92 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.794 1.237 . . . . 0.0 113.924 177.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -150.03 130.67 14.01 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.642 1.177 . . . . 0.0 110.2 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -134.47 167.67 20.35 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.784 1.233 . . . . 0.0 110.504 174.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -143.19 142.1 31.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 22.9 m -117.52 104.3 10.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.302 1.441 . . . . 0.0 110.049 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.15 -26.77 67.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.189 1.396 . . . . 0.0 113.768 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.95 -88.66 0.97 Allowed Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.882 1.23 . . . . 0.0 114.135 173.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.9 t -145.16 35.07 1.09 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 112.329 -173.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -113.48 164.38 13.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.685 1.594 . . . . 0.0 111.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -121.11 9.2 10.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.64 1.576 . . . . 0.0 113.664 -178.512 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p -138.6 167.33 22.17 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -142.14 150.23 40.82 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.335 1.054 . . . . 0.0 110.599 169.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.09 151.94 17.74 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.414 1.085 . . . . 0.0 111.67 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.3 mt -107.25 13.97 26.62 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.106 1.363 . . . . 0.0 112.191 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.78 -25.28 63.73 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--O 1.253 1.289 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 178.25 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -59.36 -13.05 6.9 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -140.21 63.51 1.47 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.101 1.76 . . . . 0.0 111.71 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 7.9 ptp -148.3 151.87 36.14 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.937 1.295 . . . . 0.0 112.566 173.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -163.36 167.94 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 112.36 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -139.05 157.04 46.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.964 1.306 . . . . 0.0 113.116 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.57 171.44 10.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.675 1.59 . . . . 0.0 112.722 168.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -125.7 135.24 26.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 125.207 1.403 . . . . 0.0 110.001 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.03 169.27 15.34 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -71.25 72.65 2.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.091 3.861 . . . . 0.0 112.176 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 11.7 p -138.68 -19.06 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.987 1.315 . . . . 0.0 113.62 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -113.11 20.04 16.64 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.756 1.622 . . . . 0.0 112.559 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -109.79 164.13 12.85 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.55 1.94 . . . . 0.0 112.276 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.2 125.85 25.87 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.666 1.187 . . . . 0.0 112.181 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -71.02 154.7 41.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.893 0.877 . . . . 0.0 112.1 173.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 24.7 t -145.31 143.76 30.36 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.124 1.37 . . . . 0.0 110.632 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 41.41 63.92 5.78 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 126.525 1.93 . . . . 0.0 112.738 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 123.919 3.079 . . . . 0.0 113.182 -178.733 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 t -72.45 -22.27 61.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.198 0.999 . . . . 0.0 113.545 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -133.94 159.66 40.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.397 1.479 . . . . 0.0 111.809 -175.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.0 174.55 9.14 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.897 1.279 . . . . 0.0 113.976 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -118.94 -68.24 0.93 Allowed 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.819 1.648 . . . . 0.0 112.35 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.21 -15.89 63.76 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.3 pt -138.46 -162.88 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 128.207 2.603 . . . . 0.0 108.722 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.03 30.26 4.0 Favored Glycine 0 CA--C 1.536 1.369 0 O-C-N 121.595 -0.69 . . . . 0.0 112.495 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.422 ' CG ' ' H ' ' A' ' 10' ' ' VAL . 6.1 p80 -136.52 -54.28 0.73 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.738 1.615 . . . . 0.0 111.323 -171.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' H ' ' CG ' ' A' ' 9' ' ' HIS . 13.5 p -52.87 136.32 13.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 126.989 2.116 . . . . 0.0 112.456 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.86 79.55 0.25 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 125.462 1.506 . . . . 0.0 109.957 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -123.99 150.78 44.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 0.0 112.917 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.45 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t -69.25 -24.75 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.79 -24.04 67.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.966 1.306 . . . . 0.0 114.207 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 125.633 1.573 . . . . 0.0 112.785 177.406 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.1 p 52.12 36.78 19.9 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.132 1.373 . . . . 0.0 113.512 -166.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -63.27 -11.26 20.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.577 1.551 . . . . 0.0 114.373 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.1 ptp -126.28 119.94 28.69 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.949 1.7 . . . . 0.0 109.425 170.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -65.56 160.62 22.02 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.638 0.775 . . . . 0.0 111.169 172.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -71.79 19.88 0.06 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 126.155 1.782 . . . . 0.0 114.639 172.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -145.03 136.47 25.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.12 1.768 . . . . 0.0 110.493 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -136.75 170.37 16.19 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.455 1.502 . . . . 0.0 111.106 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -147.26 147.94 30.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.0 m -131.88 118.13 19.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.47 1.508 . . . . 0.0 109.761 -172.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.09 85.86 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -171.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.14 85.94 0.05 OUTLIER Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.202 0.906 . . . . 0.0 114.401 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t 60.23 38.06 20.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.984 1.314 . . . . 0.0 113.929 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -133.83 154.77 50.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.379 1.471 . . . . 0.0 112.034 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt -126.87 6.13 6.64 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.912 1.685 . . . . 0.0 113.335 -176.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p -130.02 174.52 9.69 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -149.02 148.39 29.68 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.587 1.155 . . . . 0.0 111.156 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.47 144.52 36.39 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.636 0.775 . . . . 0.0 111.191 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.3 mt -95.7 11.11 34.56 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.438 1.095 . . . . 0.0 112.011 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -55.54 131.87 47.24 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.17 0.988 . . . . 0.0 113.078 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.111 1.365 . . . . 0.0 114.621 -178.625 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -63.36 -17.96 63.16 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.89 -20.59 57.93 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -108.96 138.48 45.25 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.075 1.35 . . . . 0.0 111.006 -177.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.14 -177.95 6.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.484 1.513 . . . . 0.0 111.479 -176.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -140.0 169.83 16.98 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.409 1.483 . . . . 0.0 112.399 173.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -103.01 173.4 6.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.383 1.873 . . . . 0.0 111.486 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -113.42 133.42 22.15 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.299 1.04 . . . . 0.0 109.796 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.57 165.48 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.25 76.81 1.3 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 125.0 3.8 . . . . 0.0 112.081 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.7 t -136.48 146.59 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.667 1.587 . . . . 0.0 109.097 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -137.04 172.1 13.51 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.207 1.403 . . . . 0.0 111.78 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -141.63 148.03 38.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.413 1.085 . . . . 0.0 111.436 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -154.85 168.78 25.76 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.882 1.673 . . . . 0.0 111.577 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -63.3 161.04 14.61 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.158 0.983 . . . . 0.0 112.269 173.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 82.3 p -117.71 37.48 3.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.535 1.534 . . . . 0.0 112.349 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 47.99 64.14 9.09 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.13 2.172 . . . . 0.0 113.301 -176.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.207 3.271 . . . . 0.0 113.277 -178.604 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -148.41 165.63 30.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.86 1.264 . . . . 0.0 112.637 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.2 p30 -151.85 176.0 11.89 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.775 1.63 . . . . 0.0 112.594 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.52 167.38 5.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.76 -68.12 0.95 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.43 1.492 . . . . 0.0 112.69 -176.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.33 -16.37 64.22 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 177.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.5 pt -137.66 -162.04 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 128.041 2.536 . . . . 0.0 108.611 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 106.1 30.71 4.37 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.543 -0.723 . . . . 0.0 112.407 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -137.49 -50.32 0.61 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.877 1.671 . . . . 0.0 111.611 -172.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -55.82 146.88 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 126.699 1.999 . . . . 0.0 112.395 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -117.93 85.87 0.4 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.484 1.516 . . . . 0.0 109.632 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 -131.23 150.22 52.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.015 0.926 . . . . 0.0 113.145 171.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.29 -26.72 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -17.26 51.26 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.86 -0.496 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.7 p -68.71 -27.13 65.67 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -88.66 4.52 46.87 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.942 1.697 . . . . 0.0 114.268 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 8.8 ptp -132.79 99.51 4.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.837 1.255 . . . . 0.0 111.654 -176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -125.08 54.14 1.46 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.454 2.302 . . . . 0.0 110.798 -166.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -172.93 2.74 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.376 2.27 . . . . 0.0 110.646 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -54.1 139.04 36.36 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.161 0.985 . . . . 0.0 112.352 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -133.76 165.68 24.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.722 1.209 . . . . 0.0 111.505 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -148.94 153.14 37.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 59.6 m -141.63 124.1 15.8 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.587 1.555 . . . . 0.0 110.376 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.68 67.09 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.55 72.05 0.74 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.037 0.827 . . . . 0.0 114.817 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 1.5 t 76.65 34.33 0.46 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.05 1.74 . . . . 0.0 113.977 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -129.4 145.4 51.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.427 1.491 . . . . 0.0 111.384 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 5.84 25.69 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.897 1.679 . . . . 0.0 112.728 177.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.406 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.406 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p -135.75 163.97 28.96 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -139.42 145.58 39.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.512 1.125 . . . . 0.0 110.888 172.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.2 pp -55.24 152.66 7.92 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.941 1.296 . . . . 0.0 113.238 175.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.0 11.15 18.94 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.581 1.552 . . . . 0.0 112.276 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -64.54 121.17 13.79 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.695 0.798 . . . . 0.0 111.069 170.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.255 1.352 0 C-N-CA 125.534 1.534 . . . . 0.0 112.688 -176.568 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -65.49 -21.1 66.6 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.9 -39.84 19.33 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 -173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.4 ptp -64.78 155.18 34.67 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.949 0.9 . . . . 0.0 111.829 167.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.47 178.34 10.41 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.39 . . . . 0.0 112.096 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -138.49 159.79 41.2 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.829 1.651 . . . . 0.0 111.991 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.11 -50.73 6.79 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 -171.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 9.7 mm 62.9 133.63 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 127.247 2.219 . . . . 0.0 113.479 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 165.21 30.28 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.24 71.24 2.33 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 125.159 3.906 . . . . 0.0 112.359 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.1 t -137.32 147.19 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.642 1.577 . . . . 0.0 109.138 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -132.54 159.66 38.8 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.082 1.353 . . . . 0.0 111.351 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -66.95 104.61 1.41 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.366 1.067 . . . . 0.0 111.498 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -150.69 117.66 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.23 1.412 . . . . 0.0 110.22 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -72.75 161.8 30.29 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.27 1.028 . . . . 0.0 112.397 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -110.34 1.27 18.36 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.114 1.366 . . . . 0.0 114.396 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -141.53 71.41 25.89 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.874 1.67 . . . . 0.0 110.47 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.254 1.275 0 C-N-CA 123.847 3.031 . . . . 0.0 113.019 178.271 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.556 -0.58 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -161.11 149.57 16.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.06 1.344 . . . . 0.0 111.48 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -146.83 166.11 27.68 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.275 1.83 . . . . 0.0 111.52 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -62.52 166.29 5.38 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 172.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.608 1.563 . . . . 0.0 112.447 -177.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.15 -14.43 62.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 pt -142.1 -171.55 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 127.759 2.424 . . . . 0.0 109.269 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.97 -28.63 7.22 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.262 0.934 . . . . 0.0 112.095 173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -59.86 -31.13 69.48 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.35 1.86 . . . . 0.0 114.068 173.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.62 -21.64 22.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -164.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.8 18.85 54.39 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 126.403 1.954 . . . . 0.0 117.131 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 -77.02 148.41 36.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.526 1.163 . . . . 0.0 111.965 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.35 -27.34 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -10.69 58.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.58 1.952 . . . . 0.0 115.059 175.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 125.51 1.524 . . . . 0.0 112.775 -178.201 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 60.8 p -111.93 149.58 31.7 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.811 1.245 . . . . 0.0 111.706 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -157.14 161.48 39.37 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.259 1.424 . . . . 0.0 110.308 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 7.8 ptp -56.18 134.08 52.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.262 1.025 . . . . 0.0 113.122 176.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -137.04 10.72 3.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 126.801 2.04 . . . . 0.0 113.042 -176.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.39 -41.61 63.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.194 1.397 . . . . 0.0 113.345 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -164.92 139.24 5.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.589 1.956 . . . . 0.0 109.427 170.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -133.92 163.45 29.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.785 1.234 . . . . 0.0 110.866 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -145.73 147.17 31.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 14.0 t -124.12 130.94 53.41 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.762 1.225 . . . . 0.0 111.25 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.53 65.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 54.87 49.31 62.57 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 115.065 0.786 . . . . 0.0 115.065 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.6 t 77.02 51.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.232 1.813 . . . . 0.0 113.47 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -136.13 161.43 35.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.246 1.418 . . . . 0.0 112.521 177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -116.78 -4.19 11.64 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 126.089 1.756 . . . . 0.0 113.322 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.411 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.411 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p -136.18 165.3 26.04 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -140.24 147.69 40.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.47 1.108 . . . . 0.0 110.679 170.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.13 145.66 36.06 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.109 0.964 . . . . 0.0 111.756 175.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.85 10.2 40.78 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.79 1.236 . . . . 0.0 112.096 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -55.92 140.17 43.76 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.221 1.009 . . . . 0.0 113.051 171.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.254 1.31 0 C-N-CA 125.184 1.393 . . . . 0.0 112.976 -175.422 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -72.5 -7.3 49.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -118.25 26.86 9.33 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.626 1.57 . . . . 0.0 112.162 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.1 ptp -141.5 139.64 33.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.578 1.551 . . . . 0.0 110.774 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -164.04 -174.82 3.74 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.879 1.671 . . . . 0.0 110.701 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -139.06 168.58 19.51 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.133 1.373 . . . . 0.0 112.461 171.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -101.82 171.37 7.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.026 1.73 . . . . 0.0 112.052 177.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm -122.35 133.81 24.56 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.689 1.196 . . . . 0.0 109.558 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.96 165.35 26.46 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -71.67 68.59 2.91 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 125.292 3.995 . . . . 0.0 112.4 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 64.4 t -136.46 148.68 27.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.672 1.589 . . . . 0.0 108.907 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -119.25 149.65 41.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.575 1.15 . . . . 0.0 111.627 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -104.29 -15.65 15.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.971 0.908 . . . . 0.0 112.675 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 46.45 42.3 10.61 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.336 1.855 . . . . 0.0 113.267 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -122.11 152.25 40.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.093 1.357 . . . . 0.0 112.389 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 22.5 t -160.86 146.17 14.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.107 1.363 . . . . 0.0 110.544 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 40.71 56.18 7.81 Favored Pre-proline 0 N--CA 1.483 1.216 0 C-N-CA 126.659 1.984 . . . . 0.0 114.167 175.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--O 1.256 1.403 0 C-N-CA 124.152 3.234 . . . . 0.0 113.618 -174.935 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -58.8 130.98 49.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.512 1.125 . . . . 0.0 112.777 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -112.52 89.23 3.01 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.223 1.409 . . . . 0.0 109.992 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -138.06 171.58 14.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.445 1.498 . . . . 0.0 112.515 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -118.02 -67.09 1.02 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.569 1.548 . . . . 0.0 112.16 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -15.54 63.51 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 177.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.63 -170.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 127.847 2.459 . . . . 0.0 109.238 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.97 -27.51 4.06 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.734 1.159 . . . . 0.0 111.818 172.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.9 -36.5 74.78 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.016 1.726 . . . . 0.0 113.672 170.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.9 t -77.92 128.69 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.687 1.195 . . . . 0.0 109.996 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.47 26.1 21.04 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.741 1.639 . . . . 0.0 114.681 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -67.03 150.14 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.971 1.308 . . . . 0.0 111.995 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t -69.53 -28.23 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.52 -21.53 66.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.634 1.573 . . . . 0.0 114.758 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.43 1.492 . . . . 0.0 113.699 -175.948 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.9 p -138.92 62.95 1.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.878 1.271 . . . . 0.0 112.198 -174.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -59.75 175.59 0.36 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.46 1.104 . . . . 0.0 113.114 168.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 17.5 ptp -49.18 173.11 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.548 1.539 . . . . 0.0 113.863 163.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.14 -19.34 2.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.541 1.536 . . . . 0.0 114.246 177.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 tttp 70.71 36.08 1.67 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 127.853 2.461 . . . . 0.0 111.861 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -149.86 132.65 15.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.71 1.204 . . . . 0.0 110.362 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -134.05 166.84 21.81 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.302 1.441 . . . . 0.0 109.887 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -148.2 153.08 38.29 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 90.5 m -139.97 118.51 12.25 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.484 1.514 . . . . 0.0 110.705 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.1 -32.43 73.88 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -176.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.36 -77.8 0.72 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.499 1.523 . . . . 0.0 115.046 178.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.5 p -138.76 14.0 2.7 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.403 1.481 . . . . 0.0 114.193 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -110.33 160.32 16.66 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.327 1.451 . . . . 0.0 111.979 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -118.0 12.56 13.72 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.382 1.873 . . . . 0.0 112.843 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.4 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p -132.34 175.87 8.9 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.39 152.72 33.48 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.254 1.021 . . . . 0.0 111.698 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.52 146.18 36.43 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 112.061 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.07 14.4 29.4 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.888 1.275 . . . . 0.0 111.67 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -58.94 154.7 14.77 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 171.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.826 1.65 . . . . 0.0 113.868 -177.291 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.58 -16.61 2.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -116.33 20.21 14.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.885 1.674 . . . . 0.0 111.847 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 39.9 mtm -118.06 126.43 52.25 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.948 1.299 . . . . 0.0 112.1 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.31 157.87 26.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.351 1.46 . . . . 0.0 111.517 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.2 170.75 19.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.091 1.356 . . . . 0.0 113.167 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -99.73 175.6 5.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.675 1.99 . . . . 0.0 112.636 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm -122.85 135.25 25.59 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.234 1.413 . . . . 0.0 109.661 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.73 167.57 20.82 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.17 70.58 1.79 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 125.188 3.925 . . . . 0.0 112.633 174.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 79.8 t -126.57 -30.54 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.674 1.19 . . . . 0.0 112.694 -175.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.22 135.31 38.42 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.675 1.19 . . . . 0.0 112.61 174.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -158.01 153.32 25.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.311 1.045 . . . . 0.0 111.378 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -72.78 105.63 4.42 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.09 0.956 . . . . 0.0 110.908 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -64.24 132.1 49.31 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.415 0.686 . . . . 0.0 111.943 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 51.8 m -149.59 149.9 31.39 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.764 1.625 . . . . 0.0 110.803 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? 37.55 59.87 4.27 Favored Pre-proline 0 N--CA 1.483 1.219 0 C-N-CA 126.868 2.067 . . . . 0.0 113.802 -177.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo . . . . . 0 C--O 1.253 1.265 0 C-N-CA 123.702 2.935 . . . . 0.0 113.061 -178.838 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -75.68 53.34 0.71 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.241 1.817 . . . . 0.0 113.107 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -131.9 27.62 4.57 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.452 1.901 . . . . 0.0 111.823 -170.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -137.31 175.02 9.98 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.611 1.964 . . . . 0.0 112.323 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -115.92 -63.23 1.48 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.062 1.345 . . . . 0.0 112.972 -176.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.9 -15.23 63.44 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 177.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.1 pt -141.61 -176.93 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.009 2.524 . . . . 0.0 109.309 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.28 -31.25 1.95 Allowed Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.659 1.123 . . . . 0.0 111.301 170.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.47 -48.52 80.49 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.458 1.903 . . . . 0.0 114.372 175.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.6 t -64.48 129.82 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.072 0.949 . . . . 0.0 111.096 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.95 30.12 11.07 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.216 1.389 . . . . 0.0 114.448 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -75.64 150.05 38.05 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.052 0.926 . . . . 0.0 112.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m -79.21 -18.84 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -78.46 -40.48 35.45 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.427 1.491 . . . . 0.0 112.386 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.645 1.578 . . . . 0.0 113.232 178.675 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.466 -0.653 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.7 t -151.63 165.13 35.26 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.192 1.397 . . . . 0.0 111.208 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -110.56 -13.32 14.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.5 mmt -78.18 143.3 37.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.956 0.902 . . . . 0.0 111.77 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -132.56 4.21 3.93 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.429 1.492 . . . . 0.0 113.905 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -68.0 -70.95 0.23 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.804 1.242 . . . . 0.0 111.935 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -167.24 151.25 6.7 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.487 1.915 . . . . 0.0 109.751 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -135.44 163.31 30.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.236 1.014 . . . . 0.0 111.65 173.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -144.5 151.77 39.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 40.7 m -133.65 111.7 10.83 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.422 1.489 . . . . 0.0 110.61 -169.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.46 -20.93 62.03 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.33 -102.46 0.67 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.367 0.984 . . . . 0.0 113.176 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 39.4 m -124.4 4.4 8.39 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.03 1.332 . . . . 0.0 113.927 -173.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -78.16 165.41 23.98 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.269 1.028 . . . . 0.0 112.435 176.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -123.33 11.2 9.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.796 1.638 . . . . 0.0 113.258 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p -132.05 -178.71 5.02 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.467 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 9.8 ptmm? -145.08 -89.79 0.1 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . 0.467 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 2.1 pt? -164.46 171.13 15.06 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.039 2.136 . . . . 0.0 111.415 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 19.2 mt -137.17 31.94 2.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.316 1.846 . . . . 0.0 111.47 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.53 161.49 9.56 Favored 'General case' 0 CA--C 1.552 1.039 0 O-C-N 121.512 -0.742 . . . . 0.0 111.77 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . 0.253 11.3 pt-20 . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 126.84 2.056 . . . . 0.0 115.293 -171.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -62.94 -12.47 25.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -89.03 3.61 51.09 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -142.43 80.82 1.72 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 112.181 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.99 179.75 7.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.059 1.744 . . . . 0.0 112.093 174.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -55.56 147.57 17.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.326 1.45 . . . . 0.0 114.545 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -50.95 44.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm 63.88 133.15 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 127.313 2.245 . . . . 0.0 113.606 -172.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.04 169.57 14.77 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -71.68 78.71 1.65 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.723 3.616 . . . . 0.0 111.302 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.9 p -142.8 152.63 17.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 125.374 1.469 . . . . 0.0 110.587 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 3.7 pp0? -146.39 163.47 35.5 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.484 1.514 . . . . 0.0 111.542 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -66.86 108.51 2.57 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.877 0.871 . . . . 0.0 111.449 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.83 -13.17 62.24 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -112.78 158.86 19.59 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.723 1.609 . . . . 0.0 110.571 169.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -142.23 166.09 25.64 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.719 1.207 . . . . 0.0 112.367 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.38 147.28 49.16 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.504 1.121 . . . . 0.0 113.353 -178.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 C--O 1.252 1.197 0 C-N-CA 123.882 3.055 . . . . 0.0 113.091 177.86 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t 47.45 45.24 17.18 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 127.059 2.144 . . . . 0.0 116.038 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -123.76 36.28 4.66 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.755 1.622 . . . . 0.0 112.087 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -136.91 173.44 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.577 1.551 . . . . 0.0 113.274 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -118.05 -65.85 1.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.531 1.533 . . . . 0.0 112.706 -175.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -15.58 63.67 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 176.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.8 pt -142.0 -172.78 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 128.232 2.613 . . . . 0.0 108.946 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.64 -27.94 4.3 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.587 1.089 . . . . 0.0 111.568 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.85 -42.96 90.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.929 1.692 . . . . 0.0 113.594 171.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.73 133.48 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 123.91 0.884 . . . . 0.0 110.639 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.72 84.05 0.36 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.354 1.93 . . . . 0.0 109.238 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -129.67 148.3 51.54 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.348 1.459 . . . . 0.0 111.384 175.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.07 -28.5 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.05 -8.1 46.6 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.831 2.052 . . . . 0.0 115.102 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 m120 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.697 1.999 . . . . 0.0 113.545 -175.076 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 44.1 m -80.28 -34.5 36.88 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -88.91 149.91 23.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.481 1.112 . . . . 0.0 111.723 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 44.2 mtp 61.45 110.39 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.62 2.368 . . . . 0.0 113.566 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -94.52 44.01 1.1 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.222 1.809 . . . . 0.0 112.497 -172.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -135.92 160.02 39.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.808 2.043 . . . . 0.0 110.621 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -59.21 142.89 50.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.451 0.7 . . . . 0.0 110.691 175.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -126.76 159.7 33.01 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.608 0.763 . . . . 0.0 111.493 176.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -145.3 153.96 41.83 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 15.4 t -127.25 133.85 50.15 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.857 1.263 . . . . 0.0 112.084 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.74 -14.37 58.78 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.438 1.095 . . . . 0.0 113.63 176.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 55.7 -108.54 1.1 Allowed Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.237 0.923 . . . . 0.0 112.566 -170.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 45.8 m -110.71 0.98 17.62 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.22 1.408 . . . . 0.0 114.039 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -82.46 161.16 22.51 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.02 0.928 . . . . 0.0 112.711 -176.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -118.05 8.23 12.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.885 1.674 . . . . 0.0 113.171 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p -133.94 173.18 11.84 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -133.24 -88.89 0.41 Allowed 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.5 -0.75 . . . . 0.0 111.844 174.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.1 pp -166.76 174.3 8.77 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.163 1.785 . . . . 0.0 111.506 -174.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.9 mt -132.92 17.9 4.17 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.7 1.6 . . . . 0.0 112.862 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -63.48 119.78 10.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.055 0.942 . . . . 0.0 111.425 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 125.285 1.434 . . . . 0.0 112.85 178.033 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -63.75 -12.48 35.42 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -107.76 64.37 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.171 1.389 . . . . 0.0 111.135 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 mmt -130.42 -176.34 3.93 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.188 2.195 . . . . 0.0 110.309 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.55 123.18 16.02 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.348 -0.845 . . . . 0.0 112.179 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -143.56 -55.1 0.38 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.842 1.257 . . . . 0.0 112.471 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.26 176.75 1.99 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.688 1.995 . . . . 0.0 110.49 -171.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm -113.2 134.24 21.91 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 124.38 1.072 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.11 169.69 16.08 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.39 78.69 1.54 Allowed 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.784 3.656 . . . . 0.0 111.467 174.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.6 p -144.05 148.12 18.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.265 1.426 . . . . 0.0 110.542 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.39 155.19 42.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.055 1.342 . . . . 0.0 111.149 174.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -151.13 -33.4 0.15 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -74.14 119.09 17.87 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.437 -0.789 . . . . 0.0 109.864 167.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -60.21 142.09 54.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 12.4 t -159.53 156.27 27.86 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.502 1.521 . . . . 0.0 110.806 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 32.1 mtm-85 60.2 158.41 0.11 Allowed Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 127.947 2.499 . . . . 0.0 115.072 -174.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 C--O 1.254 1.277 0 C-N-CA 123.663 2.909 . . . . 0.0 113.211 -179.72 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -125.83 -5.18 6.92 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -76.91 163.92 26.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.081 0.952 . . . . 0.0 112.546 174.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -146.72 173.82 12.01 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.365 1.466 . . . . 0.0 112.906 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -114.79 -68.48 0.92 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.602 1.561 . . . . 0.0 112.149 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -14.89 63.1 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.2 pt -141.34 -174.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.565 2.346 . . . . 0.0 109.535 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.15 -25.13 4.39 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.541 1.067 . . . . 0.0 111.94 171.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -64.01 -34.98 79.24 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.568 1.947 . . . . 0.0 114.493 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.26 158.43 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.424 1.09 . . . . 0.0 111.519 -177.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.65 30.34 4.47 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.121 1.343 . . . . 0.0 114.054 -175.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -83.84 151.06 25.35 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.187 0.994 . . . . 0.0 112.639 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t -72.96 -29.02 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -34.45 77.2 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 171.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.17 1.388 . . . . 0.0 113.146 -176.829 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.535 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.6 p -144.26 136.57 26.54 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.465 1.106 . . . . 0.0 112.139 175.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -87.21 -16.56 34.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.625 1.17 . . . . 0.0 113.325 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.0 mtp -139.35 179.2 6.68 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.006 1.722 . . . . 0.0 111.492 -174.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.73 13.27 6.9 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.761 1.625 . . . . 0.0 113.222 -177.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.5 mmpt? -95.99 165.49 12.23 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.78 1.632 . . . . 0.0 111.204 173.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -60.67 150.1 33.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.158 0.983 . . . . 0.0 111.809 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -124.84 164.67 19.52 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.064 0.945 . . . . 0.0 112.084 170.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -144.89 153.3 41.43 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 51.5 m -139.32 112.88 8.36 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.314 1.446 . . . . 0.0 110.226 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.14 69.23 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.71 -124.98 34.18 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.094 -1.004 . . . . 0.0 112.458 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.7 m -90.22 14.31 12.96 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -169.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -111.98 160.27 17.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.689 1.196 . . . . 0.0 113.202 -175.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -122.81 9.72 9.5 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.129 1.772 . . . . 0.0 113.856 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p -137.13 166.78 22.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -141.05 151.36 43.98 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.906 1.282 . . . . 0.0 110.437 170.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -64.17 158.95 21.66 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.212 1.006 . . . . 0.0 113.051 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.24 23.85 12.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.36 1.864 . . . . 0.0 111.533 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.08 -30.39 70.31 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 166.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.749 1.619 . . . . 0.0 115.136 -179.133 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -59.92 -5.02 0.85 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -129.6 39.65 3.69 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.936 1.695 . . . . 0.0 112.328 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 29.1 mtm -130.36 92.93 3.36 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.256 1.423 . . . . 0.0 111.537 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.31 168.94 25.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.001 1.32 . . . . 0.0 112.421 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -140.65 165.43 27.5 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.126 1.37 . . . . 0.0 112.619 -176.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -76.07 174.89 9.47 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.623 1.969 . . . . 0.0 112.665 169.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm -122.09 134.93 24.96 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 125.145 1.378 . . . . 0.0 109.969 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.48 169.71 15.11 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 79.94 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.733 3.622 . . . . 0.0 111.523 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.0 p -143.77 148.85 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.538 1.535 . . . . 0.0 110.269 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -142.8 -47.06 0.32 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.2 1.0 . . . . 0.0 112.491 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -74.17 90.61 2.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.269 1.028 . . . . 0.0 111.132 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.31 68.37 0.75 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.806 1.642 . . . . 0.0 112.024 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -57.68 158.93 5.6 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.2 1.4 . . . . 0.0 112.474 173.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 30.4 t -136.71 142.97 43.12 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.95 1.3 . . . . 0.0 110.505 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 47.2 ptt85 -57.87 154.84 25.8 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.943 1.297 . . . . 0.0 112.737 173.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.255 1.332 0 C-N-CA 123.468 2.778 . . . . 0.0 112.838 169.29 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.519 -0.6 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 m -66.18 -27.97 68.41 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -109.49 172.0 7.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.746 1.618 . . . . 0.0 111.229 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -58.89 164.87 2.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -111.98 -65.76 1.15 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.306 1.443 . . . . 0.0 112.342 -173.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -16.21 63.27 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 176.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.7 pt -141.7 -171.86 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 127.701 2.401 . . . . 0.0 109.068 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.05 -28.23 7.39 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.159 0.885 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -58.86 -33.77 70.85 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.209 1.804 . . . . 0.0 114.06 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 p -69.95 -21.28 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -164.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.37 56.3 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.994 1.759 . . . . 0.0 117.123 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -77.64 148.58 34.98 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.566 1.183 . . . . 0.0 112.078 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.427 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t -66.67 -25.23 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.77 -16.74 64.47 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 172.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 51.0 t30 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 126.102 1.761 . . . . 0.0 113.775 -167.886 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 CA-C-O 121.255 0.364 . . . . 0.0 112.231 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 74.5 p -137.09 54.72 1.85 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.815 1.646 . . . . 0.0 111.068 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -140.49 176.42 8.79 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.53 1.932 . . . . 0.0 112.114 -172.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 33.4 mtt 59.57 -171.9 0.12 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.977 1.711 . . . . 0.0 113.954 -177.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -124.67 162.25 24.55 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.797 1.639 . . . . 0.0 112.071 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.56 21.73 0.1 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.244 1.818 . . . . 0.0 115.41 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -138.18 131.58 30.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.018 1.327 . . . . 0.0 111.478 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -140.44 170.12 16.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.545 1.538 . . . . 0.0 111.271 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -143.51 138.36 29.14 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -112.37 103.87 12.0 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.175 1.39 . . . . 0.0 109.958 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.17 67.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.198 1.399 . . . . 0.0 114.186 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 60.66 -140.63 48.04 Favored Glycine 0 CA--C 1.536 1.358 0 O-C-N 121.317 -0.864 . . . . 0.0 113.267 -176.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 17.2 m -73.68 -3.73 30.01 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -174.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -77.85 161.35 27.68 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -118.01 5.27 12.08 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 126.129 1.772 . . . . 0.0 113.284 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p -131.55 168.82 17.02 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -139.88 144.86 37.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.496 1.118 . . . . 0.0 110.39 169.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.71 148.63 28.7 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.042 0.937 . . . . 0.0 111.389 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 27.4 mt -108.02 17.52 22.28 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.324 1.45 . . . . 0.0 111.839 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 152.84 13.76 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.307 1.043 . . . . 0.0 113.321 167.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--O 1.256 1.406 0 C-N-CA 127.331 2.252 . . . . 0.0 115.066 -175.319 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 -69.82 -11.38 60.81 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 -109.6 30.73 6.38 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.771 1.628 . . . . 0.0 111.952 -175.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 36.8 mtt -102.29 119.99 39.74 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.899 1.28 . . . . 0.0 111.114 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.7 172.03 19.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.606 1.962 . . . . 0.0 110.907 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -123.59 158.88 30.45 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.989 1.316 . . . . 0.0 112.564 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 -52.28 5.82 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 mm 64.38 133.98 0.04 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 127.524 2.33 . . . . 0.0 113.638 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.11 167.37 20.23 Favored 'Trans proline' 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.08 72.07 1.63 Allowed 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 124.984 3.789 . . . . 0.0 112.389 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 60.0 t -137.75 148.07 25.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 125.96 1.704 . . . . 0.0 108.85 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -123.95 104.1 8.71 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.824 1.25 . . . . 0.0 109.812 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -67.54 -21.15 65.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.707 1.203 . . . . 0.0 114.059 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -64.59 119.03 9.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.481 1.112 . . . . 0.0 111.046 173.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -59.61 151.81 23.78 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.704 0.764 . . . . 0.0 112.831 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 67.3 m -139.31 168.38 19.95 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.428 1.891 . . . . 0.0 111.254 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 11.7 tpp85 76.78 133.49 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 128.955 2.902 . . . . 0.0 111.896 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 C--O 1.252 1.21 0 C-N-CA 123.446 2.764 . . . . 0.0 113.148 175.559 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.466 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t -151.42 162.83 40.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.486 1.515 . . . . 0.0 111.385 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -139.0 161.64 36.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.916 1.686 . . . . 0.0 111.983 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -67.96 171.46 6.73 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.65 1.18 . . . . 0.0 114.096 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.67 -65.06 1.22 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.612 1.565 . . . . 0.0 112.883 -177.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.89 -16.33 64.03 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 177.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.9 pt -141.92 -171.24 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 128.176 2.59 . . . . 0.0 108.822 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.9 -25.95 6.01 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.427 1.013 . . . . 0.0 111.901 173.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -55.38 -48.91 73.59 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.767 1.627 . . . . 0.0 112.42 168.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.71 136.72 25.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 111.678 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.78 82.92 0.32 Allowed Glycine 0 CA--C 1.521 0.422 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -129.43 150.02 50.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.821 0.849 . . . . 0.0 112.911 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m -76.28 -18.57 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -41.42 75.29 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.868 0.867 . . . . 0.0 112.606 171.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 124.964 1.306 . . . . 0.0 112.586 -176.78 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.9 p -80.11 54.25 1.9 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.187 1.795 . . . . 0.0 113.913 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -138.26 152.55 48.67 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.797 1.639 . . . . 0.0 111.547 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.4 mtp 48.57 33.87 4.48 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.735 1.614 . . . . 0.0 114.754 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.0 8.69 4.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.331 1.853 . . . . 0.0 114.883 -172.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -51.07 -40.73 59.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.494 1.517 . . . . 0.0 112.464 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -157.92 135.33 10.31 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.907 1.283 . . . . 0.0 110.526 166.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp -131.05 171.06 13.67 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.345 1.458 . . . . 0.0 110.464 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -144.54 145.94 32.1 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 60.9 m -124.15 108.78 12.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.43 1.492 . . . . 0.0 110.122 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -34.27 76.8 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.937 1.295 . . . . 0.0 114.304 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.28 -141.8 45.06 Favored Glycine 0 CA--C 1.538 1.519 0 O-C-N 121.022 -1.049 . . . . 0.0 112.62 -169.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -71.58 4.33 3.2 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -172.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -98.42 150.4 21.66 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.782 1.174 . . . . 0.0 113.028 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.47 4.11 20.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.794 1.638 . . . . 0.0 113.816 -174.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p -136.54 168.39 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -141.04 150.33 42.84 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.669 1.188 . . . . 0.0 110.386 169.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -55.52 163.76 1.2 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.787 1.235 . . . . 0.0 113.841 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 39.7 mt -128.8 26.12 5.58 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.044 1.738 . . . . 0.0 111.898 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -63.07 156.69 24.15 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 121.58 -0.7 . . . . 0.0 112.174 169.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.388 1.475 . . . . 0.0 114.413 -178.638 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.52 -25.13 64.23 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -134.5 72.46 1.46 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.987 2.115 . . . . 0.0 110.272 -172.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 10.8 mtt -97.65 152.31 19.21 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.723 0.809 . . . . 0.0 111.774 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.11 141.21 18.4 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.005 1.322 . . . . 0.0 111.661 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -144.49 155.62 43.79 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.139 1.376 . . . . 0.0 112.642 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.37 -52.02 9.84 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm 64.06 133.21 0.03 OUTLIER Pre-proline 0 CA--C 1.56 1.343 0 C-N-CA 127.213 2.205 . . . . 0.0 113.671 -172.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 166.4 23.07 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.31 78.56 0.85 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.768 3.646 . . . . 0.0 112.127 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.6 t -138.57 137.68 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 125.782 1.633 . . . . 0.0 108.806 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -126.68 149.38 49.58 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.78 1.232 . . . . 0.0 110.867 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -68.14 -23.56 64.9 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -87.54 -16.86 33.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -76.57 172.55 12.83 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.318 1.047 . . . . 0.0 112.338 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 4.8 t -129.05 44.91 2.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.605 1.562 . . . . 0.0 111.29 -177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -136.15 152.36 75.21 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 126.601 1.96 . . . . 0.0 111.903 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.243 3.295 . . . . 0.0 113.529 -177.988 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -144.09 122.97 12.71 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.964 1.306 . . . . 0.0 110.142 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -153.56 -43.84 0.09 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.306 1.042 . . . . 0.0 112.713 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -149.44 175.17 11.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.855 1.662 . . . . 0.0 112.299 174.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -121.88 -64.91 1.17 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.69 1.596 . . . . 0.0 112.606 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -15.63 63.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.0 pt -142.05 -172.79 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 128.008 2.523 . . . . 0.0 108.913 -178.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 127.21 -21.88 5.71 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.343 0.973 . . . . 0.0 112.196 173.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -61.67 -40.5 95.15 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.672 1.589 . . . . 0.0 113.219 171.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.48 158.57 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.315 1.046 . . . . 0.0 111.24 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.01 56.94 0.73 Allowed Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.973 1.273 . . . . 0.0 112.361 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -103.52 150.56 23.79 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 118.364 1.082 . . . . 0.0 112.276 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.429 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.58 -29.57 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -9.91 47.86 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.149 1.78 . . . . 0.0 115.154 172.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 128.22 2.608 . . . . 0.0 114.494 178.24 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.752 0 N-CA-C 112.107 -0.397 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.5 m -74.89 -17.13 60.62 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -112.93 -149.16 0.44 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.653 1.581 . . . . 0.0 109.422 176.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 45.6 mmm -67.08 161.62 24.09 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.948 -1.095 . . . . 0.0 111.539 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -58.63 154.85 13.58 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.994 0.918 . . . . 0.0 112.679 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -59.96 158.15 11.38 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.917 0.887 . . . . 0.0 111.769 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 73.83 105.51 0.07 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.436 2.294 . . . . 0.0 111.495 -171.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 23.2 mtmm -132.87 164.65 26.43 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.608 1.163 . . . . 0.0 111.311 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -144.13 149.38 36.43 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 88.1 m -134.4 118.34 17.32 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.534 1.534 . . . . 0.0 110.08 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.37 79.87 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.54 57.55 8.94 Favored Glycine 0 CA--C 1.537 1.464 0 O-C-N 121.433 -0.792 . . . . 0.0 113.891 178.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 18.8 m 68.81 45.9 0.95 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.647 1.579 . . . . 0.0 114.321 176.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -120.64 164.92 15.79 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.761 1.625 . . . . 0.0 111.931 176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.1 OUTLIER -123.33 9.14 9.11 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 125.679 1.592 . . . . 0.0 113.932 -177.448 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p -132.38 172.67 12.16 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -134.13 -85.25 0.43 Allowed 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.402 -0.811 . . . . 0.0 112.144 174.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -166.6 174.77 8.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.537 1.935 . . . . 0.0 111.566 -174.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.4 mt -132.93 22.17 4.17 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.725 1.61 . . . . 0.0 112.752 174.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -60.9 162.36 7.0 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.972 0.909 . . . . 0.0 112.254 166.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.567 1.947 . . . . 0.0 114.066 -175.731 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 -57.03 -12.11 1.9 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -128.92 33.27 4.64 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.149 1.779 . . . . 0.0 111.626 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 30.5 mtm -130.01 158.58 39.21 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 112.43 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.85 179.65 8.89 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 111.97 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.52 161.77 40.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.466 1.506 . . . . 0.0 113.461 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.6 p-80 -85.99 176.08 8.24 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.919 1.688 . . . . 0.0 112.465 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -125.53 136.05 27.78 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 125.375 1.47 . . . . 0.0 109.839 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.27 166.58 24.76 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.31 70.64 1.86 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.001 3.8 . . . . 0.0 112.551 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.45 93.55 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.089 1.355 . . . . 0.0 109.359 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -142.32 172.09 13.16 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.652 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -56.38 150.21 15.27 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.129 0.972 . . . . 0.0 112.613 172.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -79.93 126.71 31.36 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.65 0.78 . . . . 0.0 110.915 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -107.95 -43.04 4.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.766 0.826 . . . . 0.0 113.04 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 38.5 m -148.19 -34.61 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -172.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -118.36 153.1 51.62 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.287 1.835 . . . . 0.0 110.393 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.882 3.055 . . . . 0.0 113.015 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -74.4 66.8 1.38 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.534 1.934 . . . . 0.0 113.994 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -133.56 177.59 7.58 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.223 1.809 . . . . 0.0 111.917 -178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -124.53 176.86 6.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.009 1.724 . . . . 0.0 112.743 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -111.44 -77.09 0.59 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.754 1.621 . . . . 0.0 111.935 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.22 -15.82 28.01 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.1 pt -138.05 -9.59 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 125.968 1.707 . . . . 0.0 113.587 -172.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -85.63 -20.9 55.37 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 123.866 0.746 . . . . 0.0 113.297 178.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -53.89 -30.07 44.43 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.969 1.308 . . . . 0.0 113.039 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -20.75 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.648 1.979 . . . . 0.0 114.437 -177.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.56 27.02 53.78 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.382 1.468 . . . . 0.0 116.261 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -81.38 146.29 30.39 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.908 1.354 . . . . 0.0 111.559 178.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.436 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -65.97 -24.28 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -14.45 49.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.179 1.392 . . . . 0.0 114.642 173.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.1 t30 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 126.639 1.976 . . . . 0.0 113.893 -171.856 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 CA-C-O 121.158 0.31 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.5 t 52.35 36.82 20.79 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 126.297 1.839 . . . . 0.0 115.169 175.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -92.38 19.71 6.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.269 1.428 . . . . 0.0 113.722 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 79.0 mtp -130.84 163.99 26.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.898 1.679 . . . . 0.0 111.835 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -58.07 133.52 55.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.6 1.16 . . . . 0.0 110.301 174.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -67.09 31.59 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.641 2.376 . . . . 0.0 116.812 -174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -128.39 112.74 14.74 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.194 1.397 . . . . 0.0 110.164 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm -133.44 161.92 33.26 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.919 0.887 . . . . 0.0 111.47 178.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -140.56 131.78 26.53 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 23.3 m -103.46 97.0 7.12 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.145 1.378 . . . . 0.0 110.163 -179.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -24.68 66.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.972 1.309 . . . . 0.0 114.074 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.15 -143.24 48.33 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.185 -0.947 . . . . 0.0 113.136 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.7 p -74.25 -3.75 31.93 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -69.37 161.33 29.59 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -176.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -120.53 5.07 10.63 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.413 1.885 . . . . 0.0 114.024 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p -137.04 171.87 13.85 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.1 -83.18 0.47 Allowed 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 172.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.1 pp -168.17 172.55 8.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.117 1.767 . . . . 0.0 111.681 -171.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.0 mt -135.43 15.51 3.44 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.629 1.571 . . . . 0.0 113.127 173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -70.14 -11.15 60.68 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.698 1.999 . . . . 0.0 112.595 -177.855 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -7.92 19.46 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.96 2.04 53.22 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.672 1.189 . . . . 0.0 112.521 171.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.1 mtm -121.61 26.14 8.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.651 1.58 . . . . 0.0 112.606 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.54 -173.05 3.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.95 2.1 . . . . 0.0 111.256 -174.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.25 156.81 14.67 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 172.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -73.59 171.25 13.57 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.481 1.513 . . . . 0.0 112.738 167.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm -129.04 136.36 29.06 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.526 1.531 . . . . 0.0 109.925 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.81 166.98 22.56 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.8 62.27 3.07 Favored 'Trans proline' 0 CA--C 1.543 0.939 1 C-N-CA 125.304 4.003 . . . . 0.0 113.127 177.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 38.2 t -138.06 144.3 31.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.212 1.405 . . . . 0.0 109.553 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -132.13 44.52 2.89 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.141 1.376 . . . . 0.0 111.897 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -72.44 176.54 5.28 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.993 1.317 . . . . 0.0 113.585 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 37.9 mp0 -130.95 161.05 32.76 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.537 1.535 . . . . 0.0 111.773 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -61.55 159.55 12.87 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 48.2 m -147.57 173.95 12.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.346 1.458 . . . . 0.0 112.574 176.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -130.38 153.94 81.42 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.062 2.145 . . . . 0.0 111.053 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.954 3.103 . . . . 0.0 113.137 178.237 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -155.14 -174.01 4.8 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.113 1.365 . . . . 0.0 111.763 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -133.35 35.0 3.47 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.667 1.987 . . . . 0.0 112.258 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -141.63 177.16 8.34 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.894 1.678 . . . . 0.0 113.094 -172.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -116.16 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.608 1.563 . . . . 0.0 111.676 -179.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.65 -4.3 6.04 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -138.52 -31.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 125.458 1.503 . . . . 0.0 113.874 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.32 -24.81 61.82 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.955 1.264 . . . . 0.0 114.699 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -66.76 -39.85 88.04 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.705 0.802 . . . . 0.0 112.862 169.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 157.81 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 126.887 2.075 . . . . 0.0 111.157 178.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.34 31.42 4.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.889 1.233 . . . . 0.0 113.655 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.0 t90 -82.74 149.26 27.38 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.547 -0.972 . . . . 0.0 112.334 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.5 -28.64 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -24.79 67.54 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 173.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 125.288 1.435 . . . . 0.0 112.434 -176.283 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -147.3 34.01 0.88 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.692 1.197 . . . . 0.0 112.789 -170.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -114.97 122.63 46.85 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.103 1.361 . . . . 0.0 110.191 -177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 86.2 mtp 50.18 35.77 11.02 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 123.402 1.573 . . . . 0.0 114.579 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -101.23 37.56 1.75 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.913 2.485 . . . . 0.0 111.951 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.26 179.54 0.1 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.413 1.485 . . . . 0.0 111.165 165.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -50.81 133.54 26.22 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.757 -0.59 . . . . 0.0 111.022 172.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm -126.47 163.54 23.11 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.912 0.885 . . . . 0.0 110.901 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -143.82 150.2 38.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 53.0 m -137.55 111.59 8.39 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.336 1.455 . . . . 0.0 110.017 -173.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.7 -39.4 65.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.572 1.549 . . . . 0.0 115.036 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.07 69.42 1.37 Allowed Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.295 -0.878 . . . . 0.0 112.809 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 16.2 m 63.0 27.73 16.01 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.518 1.527 . . . . 0.0 115.048 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -112.16 152.89 27.81 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.121 1.369 . . . . 0.0 112.313 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.14 -2.71 14.88 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.82 1.648 . . . . 0.0 114.082 -175.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -134.99 171.62 14.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -132.55 -86.79 0.45 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.257 0.623 . . . . 0.0 112.143 173.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 pp -166.22 173.62 9.98 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.246 1.819 . . . . 0.0 111.645 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -134.32 18.88 3.68 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.707 1.603 . . . . 0.0 112.584 173.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.23 155.87 19.92 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.075 0.95 . . . . 0.0 111.908 166.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.871 2.068 . . . . 0.0 114.445 -173.336 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -52.66 -24.79 9.2 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -74.04 -12.46 60.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.816 1.646 . . . . 0.0 114.002 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 2.1 ptm -152.59 52.11 0.77 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.473 1.509 . . . . 0.0 112.22 -165.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -146.09 174.18 11.53 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.331 1.453 . . . . 0.0 112.954 -175.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -118.93 160.37 22.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.774 1.23 . . . . 0.0 113.34 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -72.35 174.34 7.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.703 2.001 . . . . 0.0 112.877 169.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm -123.87 134.84 25.65 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 125.209 1.404 . . . . 0.0 110.154 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.97 167.23 22.17 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -68.76 78.17 0.72 Allowed 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.707 3.605 . . . . 0.0 112.19 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.0 t -138.79 142.63 33.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.678 1.591 . . . . 0.0 109.416 -177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -146.45 -178.64 6.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.572 1.549 . . . . 0.0 111.636 -178.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -55.53 144.23 26.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.903 0.881 . . . . 0.0 112.198 175.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 53.28 43.46 31.45 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -170.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -54.09 149.6 9.22 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.662 1.185 . . . . 0.0 114.024 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.7 p -159.61 160.94 34.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.239 1.416 . . . . 0.0 111.964 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -147.57 71.27 11.67 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 125.05 1.34 . . . . 0.0 111.304 174.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 123.61 2.874 . . . . 0.0 112.944 176.838 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.2 m 51.22 34.76 11.97 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.043 1.737 . . . . 0.0 115.197 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -67.12 -21.11 65.86 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.664 1.186 . . . . 0.0 114.0 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -142.55 174.25 10.8 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.302 1.841 . . . . 0.0 111.61 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -119.62 -61.9 1.56 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.234 1.413 . . . . 0.0 112.646 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -16.8 64.5 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.2 pt -142.29 -177.17 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 127.941 2.496 . . . . 0.0 109.67 -176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 132.98 -24.63 3.79 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.496 1.046 . . . . 0.0 112.086 171.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -63.59 -46.77 84.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.022 1.729 . . . . 0.0 114.226 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.66 156.69 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 124.93 1.292 . . . . 0.0 111.726 -176.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.04 31.72 4.41 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.067 1.318 . . . . 0.0 114.442 -175.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -77.71 149.22 34.61 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.58 -0.953 . . . . 0.0 112.583 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t -75.79 -30.03 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.79 -31.6 71.59 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 169.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.1 t30 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 124.814 1.246 . . . . 0.0 113.329 -175.182 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.074 -0.41 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 34.5 t -152.19 152.06 31.77 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.954 1.301 . . . . 0.0 111.986 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -94.93 -4.2 47.23 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.295 1.438 . . . . 0.0 113.404 173.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 43.0 mtp -77.59 178.58 7.16 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.659 1.184 . . . . 0.0 112.495 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.27 167.71 2.33 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.109 1.364 . . . . 0.0 113.771 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.54 10.05 35.2 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 126.546 1.938 . . . . 0.0 114.991 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -122.78 15.21 10.12 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.562 1.545 . . . . 0.0 115.127 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -62.61 167.42 4.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.843 0.857 . . . . 0.0 112.619 -170.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -141.05 136.16 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 39.6 m -106.27 98.0 7.74 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.531 1.532 . . . . 0.0 110.312 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.17 66.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.017 1.327 . . . . 0.0 114.245 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.42 49.58 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.378 -0.826 . . . . 0.0 113.39 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.6 p -75.87 -0.58 21.8 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.85 166.83 10.47 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HE2' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -120.45 0.65 10.57 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.344 1.458 . . . . 0.0 114.335 -176.789 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p -131.07 -171.91 2.7 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.434 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 0.3 OUTLIER -150.3 -88.23 0.07 Allowed 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.221 -0.924 . . . . 0.0 112.544 177.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . 0.434 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 0.0 OUTLIER -153.3 -175.23 5.25 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.784 2.433 . . . . 0.0 110.436 178.497 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.8 mt -133.19 19.33 4.04 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 169.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -57.3 158.13 5.75 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.81 2.044 . . . . 0.0 115.911 -168.891 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 -62.67 -12.33 22.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 31.0 m120 -131.15 70.97 1.46 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.681 1.992 . . . . 0.0 110.868 -176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 14.3 mtp -128.13 107.04 9.48 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.877 1.271 . . . . 0.0 111.706 -177.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.24 152.04 21.81 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.802 1.241 . . . . 0.0 112.225 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -163.27 166.44 23.14 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.382 1.473 . . . . 0.0 113.443 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -87.68 176.63 7.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.603 1.961 . . . . 0.0 112.711 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm -121.62 134.78 24.7 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.189 1.396 . . . . 0.0 110.251 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.15 165.86 27.03 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.02 79.49 1.02 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.585 3.523 . . . . 0.0 111.899 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 58.3 t -137.87 106.25 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.127 1.371 . . . . 0.0 109.267 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -151.78 -159.34 1.01 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.968 1.707 . . . . 0.0 110.462 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.99 99.71 0.37 Allowed 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.018 -1.052 . . . . 0.0 111.445 171.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -112.37 158.72 19.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.179 1.791 . . . . 0.0 111.567 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.89 -33.73 62.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.714 0.805 . . . . 0.0 112.911 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 89.5 p 42.76 32.1 0.36 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.949 2.499 . . . . 0.0 116.47 -176.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 62.31 149.71 0.1 OUTLIER Pre-proline 0 N--CA 1.486 1.336 0 C-N-CA 128.949 2.899 . . . . 0.0 114.632 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo . . . . . 0 C--O 1.254 1.305 0 C-N-CA 123.7 2.934 . . . . 0.0 113.191 177.906 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -149.01 54.48 0.98 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.688 1.595 . . . . 0.0 111.449 -174.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -134.82 170.59 15.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.211 1.805 . . . . 0.0 112.716 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -66.78 166.09 13.86 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -110.68 -68.35 0.93 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.46 1.504 . . . . 0.0 112.437 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -14.6 63.13 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 pt -141.07 -167.67 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 127.475 2.31 . . . . 0.0 109.271 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.01 -33.76 2.87 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.15 1.357 . . . . 0.0 110.706 171.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -57.5 -25.72 60.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.49 2.316 . . . . 0.0 115.315 172.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.7 t -78.55 -36.17 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.945 0.898 . . . . 0.0 113.417 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.96 26.99 63.93 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.957 1.265 . . . . 0.0 116.043 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -79.51 148.86 31.66 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.694 1.247 . . . . 0.0 112.039 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t -73.08 -32.29 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.95 -25.58 63.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.202 1.801 . . . . 0.0 114.122 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 124.93 1.292 . . . . 0.0 112.813 174.121 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 76.3 p -146.01 150.15 35.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.786 1.234 . . . . 0.0 112.461 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -71.97 -42.1 66.92 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.168 0.587 . . . . 0.0 111.5 170.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 65.9 mtp -82.8 166.61 18.86 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.583 1.153 . . . . 0.0 111.908 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -49.06 146.53 3.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.974 1.709 . . . . 0.0 113.672 174.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.84 58.91 4.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.692 1.597 . . . . 0.0 112.018 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -146.53 112.78 5.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.898 1.279 . . . . 0.0 110.71 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -138.83 167.32 22.26 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.668 1.187 . . . . 0.0 111.507 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -147.58 151.01 35.56 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 55.7 m -136.22 123.21 21.47 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.291 1.437 . . . . 0.0 109.81 -173.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -56.97 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -172.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.0 93.12 0.05 OUTLIER Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.322 0.963 . . . . 0.0 113.778 -178.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . 0.257 94.2 p 49.33 37.88 12.56 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.632 1.973 . . . . 0.0 115.997 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -122.73 157.63 31.91 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.93 1.692 . . . . 0.0 111.449 174.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -123.82 13.76 9.25 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.863 1.665 . . . . 0.0 112.801 177.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p -132.56 165.95 23.21 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -140.55 147.56 39.66 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.618 1.167 . . . . 0.0 110.357 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.2 154.73 26.53 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.867 0.841 . . . . 0.0 112.073 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 33.1 mt -108.44 16.8 22.75 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.53 1.532 . . . . 0.0 111.847 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.41 148.96 17.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 167.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.255 1.39 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 177.442 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -63.37 -16.51 60.66 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -98.64 33.18 2.34 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.54 1.536 . . . . 0.0 111.182 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 40.2 mtt -128.34 121.51 29.33 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.357 1.463 . . . . 0.0 110.811 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.43 171.24 18.55 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.587 1.555 . . . . 0.0 111.738 -177.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -136.35 154.26 50.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.766 1.226 . . . . 0.0 112.62 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -66.42 168.3 9.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.359 1.464 . . . . 0.0 112.412 168.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.62 133.96 25.2 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.915 1.286 . . . . 0.0 109.796 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.38 166.44 25.47 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.89 70.1 2.21 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 125.192 3.928 . . . . 0.0 112.336 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.87 142.59 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 108.786 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -138.04 113.67 9.67 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.631 1.173 . . . . 0.0 109.961 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.85 129.86 42.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.952 0.901 . . . . 0.0 111.56 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -155.6 145.69 21.61 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.967 1.307 . . . . 0.0 110.073 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -102.94 142.25 34.36 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.2 1.0 . . . . 0.0 111.845 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 73.5 p -156.15 151.4 26.62 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.693 1.597 . . . . 0.0 111.277 173.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 89.8 mtt-85 36.07 58.78 3.17 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 127.215 2.206 . . . . 0.0 114.76 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 C--O 1.254 1.31 0 C-N-CA 124.072 3.182 . . . . 0.0 113.523 -176.284 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -111.63 7.41 20.46 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.707 1.203 . . . . 0.0 113.239 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -131.42 177.37 7.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.689 1.996 . . . . 0.0 110.728 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.04 168.48 2.43 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -109.83 -51.35 2.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.171 1.788 . . . . 0.0 113.771 -173.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -62.95 -13.98 41.54 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 176.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.55 HG13 ' H ' ' A' ' 8' ' ' GLY . 22.3 pt -118.62 -99.74 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.087 1.355 . . . . 0.0 109.37 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.55 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 68.45 23.43 75.15 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.223 0.916 . . . . 0.0 113.399 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -127.48 -43.85 1.57 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.919 1.688 . . . . 0.0 111.59 -175.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.35 156.39 4.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 125.062 1.345 . . . . 0.0 111.717 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.92 84.7 0.37 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 173.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -135.17 149.79 50.03 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.717 0.807 . . . . 0.0 112.372 172.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.59 -28.52 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.35 -12.36 56.36 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.826 1.65 . . . . 0.0 114.76 173.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m120 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.765 2.026 . . . . 0.0 111.436 -177.59 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.468 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.1 t -61.43 137.5 58.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.873 1.269 . . . . 0.0 113.114 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -97.22 -28.4 14.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 77.0 mmm -131.41 156.98 44.64 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.833 1.653 . . . . 0.0 110.827 -175.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptp -116.95 -14.19 10.65 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -166.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -64.26 169.48 4.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.905 1.282 . . . . 0.0 111.456 164.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.28 134.55 57.1 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.643 0.777 . . . . 0.0 111.966 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm -134.61 167.93 19.92 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.551 1.14 . . . . 0.0 112.119 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -143.96 141.29 30.12 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 66.9 m -116.04 101.98 9.23 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.175 1.39 . . . . 0.0 110.188 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.81 66.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.254 1.421 . . . . 0.0 114.653 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.96 -129.45 43.89 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.512 -0.742 . . . . 0.0 112.466 -174.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.9 p -91.76 -3.27 56.38 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -176.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.06 160.15 21.64 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.376 1.07 . . . . 0.0 113.643 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -122.28 16.24 10.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.689 1.996 . . . . 0.0 112.449 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p -135.68 167.19 21.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.12 142.42 36.04 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.509 1.124 . . . . 0.0 110.352 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.8 mt -60.02 147.66 38.27 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.312 1.045 . . . . 0.0 112.027 176.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 32.7 mt -102.78 18.4 21.56 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.217 1.407 . . . . 0.0 111.313 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.35 156.96 9.27 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 169.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.384 1.474 . . . . 0.0 113.654 178.564 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -21.0 7.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -95.89 2.91 53.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.108 1.363 . . . . 0.0 113.07 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 22.2 mtm -124.99 52.72 1.55 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.471 1.508 . . . . 0.0 111.737 -169.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -141.37 -175.87 4.51 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.372 1.869 . . . . 0.0 111.61 -173.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.37 157.87 45.77 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.468 1.107 . . . . 0.0 113.445 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -70.52 165.99 21.5 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.387 1.475 . . . . 0.0 112.622 171.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -127.93 135.5 27.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.491 1.516 . . . . 0.0 109.315 174.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.98 167.6 17.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.87 76.98 1.95 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 125.116 3.877 . . . . 0.0 110.958 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.79 154.38 26.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 125.491 1.516 . . . . 0.0 109.753 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -123.98 136.3 54.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.798 1.239 . . . . 0.0 109.346 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -132.87 138.26 46.96 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.776 1.23 . . . . 0.0 109.951 -174.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.93 149.74 49.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.344 0.658 . . . . 0.0 111.58 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -137.3 149.02 46.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.677 1.191 . . . . 0.0 112.062 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 26.1 t -156.38 151.53 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 110.952 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -65.67 153.1 91.52 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.388 1.075 . . . . 0.0 112.112 171.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.254 1.323 0 C-N-CA 124.16 3.24 . . . . 0.0 113.23 178.706 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.6 m -145.71 161.99 38.62 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.928 1.691 . . . . 0.0 111.541 -175.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -148.7 -176.38 5.3 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.434 1.494 . . . . 0.0 112.311 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -119.93 171.51 8.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.566 1.546 . . . . 0.0 113.16 -177.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -116.9 -67.94 0.96 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.845 1.658 . . . . 0.0 112.064 -175.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.92 -15.11 63.01 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.9 pt -141.28 -173.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.533 2.333 . . . . 0.0 109.477 -177.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 131.1 -24.16 4.27 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.748 1.166 . . . . 0.0 111.788 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -66.57 -34.97 79.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.572 1.949 . . . . 0.0 114.593 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.6 161.67 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 124.314 1.046 . . . . 0.0 111.623 -175.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -130.12 31.29 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.989 1.28 . . . . 0.0 114.339 -175.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -83.57 151.36 25.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.286 1.043 . . . . 0.0 112.698 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m -72.14 -22.42 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -40.92 84.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.734 1.213 . . . . 0.0 113.029 175.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.071 1.748 . . . . 0.0 112.162 -179.317 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 CA-C-O 119.669 -0.517 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.0 m 51.72 37.28 19.78 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.016 1.726 . . . . 0.0 115.648 171.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -137.44 171.61 14.22 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.592 1.157 . . . . 0.0 113.775 -174.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 22.2 mmt -87.85 16.74 5.47 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.228 1.811 . . . . 0.0 114.314 -170.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt 47.17 32.97 2.24 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 130.198 3.399 . . . . 0.0 115.36 -169.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -137.86 167.13 22.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.522 1.929 . . . . 0.0 111.479 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -63.07 161.79 12.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.905 1.682 . . . . 0.0 112.891 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -128.63 162.97 26.08 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.342 1.057 . . . . 0.0 112.361 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 -143.85 150.36 38.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 89.8 m -133.62 109.81 9.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.593 1.557 . . . . 0.0 109.889 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.03 -26.48 67.65 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.24 41.46 94.75 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 121.171 -0.955 . . . . 0.0 113.61 -176.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 5.5 t 71.84 16.03 5.66 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.639 1.976 . . . . 0.0 115.282 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.98 164.41 20.05 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 112.785 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -113.52 4.65 16.29 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.977 1.711 . . . . 0.0 113.996 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p -131.83 170.9 14.2 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -151.49 161.74 42.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.045 0.938 . . . . 0.0 111.478 167.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.2 154.55 5.68 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.335 1.054 . . . . 0.0 113.015 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 12.4 mt -103.34 15.57 28.77 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.356 1.462 . . . . 0.0 112.102 174.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -67.99 -16.03 63.87 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 126.221 1.808 . . . . 0.0 115.135 176.003 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -69.82 -4.0 18.19 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -138.14 30.45 2.45 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.467 1.507 . . . . 0.0 113.305 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.0 mtp -63.97 140.4 58.87 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.114 -0.991 . . . . 0.0 112.219 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.33 170.19 22.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.118 1.367 . . . . 0.0 111.631 174.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -157.89 -176.52 5.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.3 1.84 . . . . 0.0 111.331 -177.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.96 -50.37 2.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.893 1.277 . . . . 0.0 114.141 -176.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm 65.34 131.35 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.273 0 C-N-CA 127.723 2.409 . . . . 0.0 113.491 -174.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -68.47 169.84 16.27 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.17 77.73 1.56 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.574 3.516 . . . . 0.0 111.73 176.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.4 p -144.94 119.85 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.503 1.121 . . . . 0.0 111.243 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -147.17 -177.72 5.83 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.696 1.999 . . . . 0.0 110.448 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -73.63 80.6 1.51 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.602 1.561 . . . . 0.0 112.206 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 174.04 11.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.481 1.113 . . . . 0.0 113.48 175.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -105.32 152.75 22.53 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.547 1.139 . . . . 0.0 112.714 173.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 62.2 m -148.45 176.24 10.46 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.164 1.785 . . . . 0.0 111.355 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.55 64.16 9.02 Favored Pre-proline 0 N--CA 1.485 1.31 0 C-N-CA 125.948 1.699 . . . . 0.0 113.012 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--O 1.251 1.154 0 C-N-CA 124.137 3.225 . . . . 0.0 113.192 178.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.168 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.7 p -142.45 31.6 1.5 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.104 1.362 . . . . 0.0 113.542 -168.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -134.52 138.58 44.77 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.163 1.385 . . . . 0.0 111.246 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -145.63 -175.84 4.89 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.052 1.741 . . . . 0.0 111.657 -173.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -85.72 -76.94 0.31 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.696 0.798 . . . . 0.0 112.522 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.54 -11.91 61.11 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.1 pt -140.53 -174.43 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.54 2.336 . . . . 0.0 109.42 -177.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 141.45 -32.15 2.09 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.606 1.098 . . . . 0.0 111.047 166.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -59.26 -39.96 84.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.805 2.042 . . . . 0.0 114.605 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -73.04 134.65 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.547 1.139 . . . . 0.0 110.42 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -110.53 27.03 11.87 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.354 1.454 . . . . 0.0 114.662 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -70.47 150.52 46.1 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.531 1.132 . . . . 0.0 112.334 -177.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t -66.27 -23.24 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -22.07 61.42 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 171.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.799 2.44 . . . . 0.0 114.084 -178.561 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 111.599 -0.6 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -61.75 125.31 23.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.366 1.066 . . . . 0.0 112.492 -179.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -158.5 155.94 29.35 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.383 1.473 . . . . 0.0 110.938 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 23.3 ptp -65.48 173.46 2.67 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.836 0.854 . . . . 0.0 112.979 167.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -59.03 156.3 12.04 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 121.398 -0.814 . . . . 0.0 112.69 174.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -88.66 16.32 6.86 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.075 1.75 . . . . 0.0 114.856 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -122.22 130.43 53.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.242 1.417 . . . . 0.0 110.526 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -143.48 167.67 21.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.645 1.178 . . . . 0.0 111.402 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -141.47 147.78 38.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 35.8 m -133.19 103.72 6.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.38 1.472 . . . . 0.0 109.991 -171.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.11 -27.47 68.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.198 1.399 . . . . 0.0 114.168 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.95 -72.85 1.55 Allowed Glycine 0 CA--C 1.533 1.215 0 C-N-CA 126.073 1.797 . . . . 0.0 114.129 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.1 m -144.93 0.64 0.96 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -80.34 165.96 21.78 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.487 1.115 . . . . 0.0 112.987 -178.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -121.32 9.17 10.33 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.374 1.869 . . . . 0.0 112.22 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.412 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p -135.29 -177.43 4.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.472 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 15.3 pttp -147.82 -96.38 0.08 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.888 0.875 . . . . 0.0 111.871 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . 0.472 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 50.0 mt -141.86 174.2 10.81 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.045 2.938 . . . . 0.0 109.199 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.1 mt -115.08 7.6 15.48 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.432 1.093 . . . . 0.0 112.558 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.12 157.2 29.26 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.978 0.911 . . . . 0.0 112.641 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 127.23 2.212 . . . . 0.0 114.553 -174.989 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -65.22 -0.33 1.7 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -127.23 68.47 1.28 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.766 1.627 . . . . 0.0 110.344 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.2 mtt -136.44 174.67 10.37 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.37 1.868 . . . . 0.0 111.672 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . 63.75 178.89 0.16 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.772 2.029 . . . . 0.0 114.295 -171.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.78 166.54 30.16 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -169.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -81.54 175.95 10.08 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 112.546 175.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm -116.3 135.48 22.85 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.875 1.27 . . . . 0.0 109.862 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -68.94 161.46 45.62 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.67 78.66 1.65 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 124.639 3.56 . . . . 0.0 111.742 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 28.3 t -129.99 77.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.194 1.397 . . . . 0.0 109.234 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -154.78 172.9 17.22 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.408 1.483 . . . . 0.0 110.181 175.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -56.55 157.5 5.17 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.209 1.004 . . . . 0.0 112.881 173.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -55.68 130.12 41.91 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.395 1.478 . . . . 0.0 113.277 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -74.44 167.37 21.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.85 1.26 . . . . 0.0 112.953 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 66.2 m -137.01 163.47 30.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.845 1.658 . . . . 0.0 111.61 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -141.32 59.42 10.34 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.857 1.263 . . . . 0.0 112.421 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--O 1.251 1.164 0 C-N-CA 123.997 3.131 . . . . 0.0 113.343 -178.289 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.857 -0.497 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 p -90.09 179.53 5.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.89 8.38 44.81 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.991 1.316 . . . . 0.0 113.689 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.68 174.65 10.72 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.2 -62.26 1.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.848 1.659 . . . . 0.0 112.895 -175.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.51 -13.16 38.19 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 175.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.535 HG13 ' H ' ' A' ' 8' ' ' GLY . 20.2 pt -133.52 -66.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.749 1.22 . . . . 0.0 111.294 -178.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.535 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 73.88 6.67 73.57 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.586 1.089 . . . . 0.0 115.344 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -123.23 8.38 9.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.272 1.429 . . . . 0.0 113.388 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 t -136.84 124.59 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.505 1.122 . . . . 0.0 109.738 -171.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.95 35.35 5.09 Favored Glycine 0 N--CA 1.473 1.128 0 C-N-CA 124.874 1.226 . . . . 0.0 113.634 -170.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -80.67 149.9 29.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.779 0.831 . . . . 0.0 112.428 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t -72.55 -26.71 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -30.56 71.6 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 170.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 C--O 1.254 1.324 0 C-N-CA 124.991 1.317 . . . . 0.0 113.499 -173.786 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 112.443 -0.263 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 47.21 48.65 15.9 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.452 1.901 . . . . 0.0 114.008 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -57.0 -22.67 40.25 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.914 2.086 . . . . 0.0 115.245 -175.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 30.1 mtm -140.78 138.18 33.91 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.84 1.656 . . . . 0.0 110.357 172.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -134.88 5.99 3.38 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.525 1.53 . . . . 0.0 113.955 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -38.22 84.8 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.98 0.809 . . . . 0.0 112.088 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -158.65 132.4 7.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.174 0.99 . . . . 0.0 111.451 166.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt -139.0 166.42 24.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.892 1.677 . . . . 0.0 111.253 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -145.74 148.47 33.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 36.3 m -125.65 95.92 4.61 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.369 1.468 . . . . 0.0 110.466 -171.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.52 -30.39 71.43 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.169 1.388 . . . . 0.0 114.69 -177.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.89 -144.37 48.97 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 121.344 -0.847 . . . . 0.0 112.96 -171.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 73.6 p -69.37 -12.47 61.68 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -66.39 120.41 13.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.32 1.048 . . . . 0.0 112.584 -178.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 4.52 20.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.432 1.493 . . . . 0.0 114.635 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.406 ' CD1' ' HB2' ' B' ' 124' ' ' SER . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.406 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.9 p -133.95 170.68 15.26 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -152.66 155.82 38.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.312 1.445 . . . . 0.0 111.002 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.4 mp -59.72 159.41 8.77 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.819 0.818 . . . . 0.0 112.408 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -107.56 16.48 23.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.376 1.47 . . . . 0.0 112.204 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -56.64 145.47 28.52 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.619 0.768 . . . . 0.0 112.87 166.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.488 1.435 0 C-N-CA 127.328 2.251 . . . . 0.0 115.001 -173.315 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 149' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -70.84 1.04 5.98 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -116.54 16.25 15.55 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.582 1.553 . . . . 0.0 113.79 175.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 20.1 mtt -70.76 -173.75 0.81 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.973 0.909 . . . . 0.0 112.249 167.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -51.69 126.73 18.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.968 1.307 . . . . 0.0 113.758 -178.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -143.36 -55.78 0.4 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.889 1.276 . . . . 0.0 112.109 -173.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.77 175.81 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.006 2.122 . . . . 0.0 110.44 -172.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm -112.29 134.84 21.43 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.444 1.097 . . . . 0.0 109.647 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 162' ' ' ALA . . . . . . . . . . . . . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 163' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.84 168.83 19.17 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.11 75.59 2.27 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 124.848 3.699 . . . . 0.0 111.438 174.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.3 p -143.2 145.56 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.903 1.281 . . . . 0.0 110.921 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 50.86 26.2 2.52 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.671 1.588 . . . . 0.0 114.253 -174.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 49.9 p30 -148.87 179.42 7.87 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.255 1.822 . . . . 0.0 112.074 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -144.95 141.55 29.09 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.139 1.376 . . . . 0.0 110.208 175.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -141.68 174.06 10.92 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.201 1.401 . . . . 0.0 112.096 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 2.9 t -121.75 30.26 6.76 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.814 1.646 . . . . 0.0 111.836 -178.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 50.1 mmm-85 -132.77 57.05 25.63 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 126.906 2.083 . . . . 0.0 111.611 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.007 3.138 . . . . 0.0 113.36 -179.167 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 120.615 0.245 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.465 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.585 HD21 HD22 ' C' ' 140' ' ' LEU . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.525 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.4 HD11 HD21 ' C' ' 140' ' ' LEU . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.525 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.457 HG23 HG23 ' C' ' 149' ' ' ILE . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.412 0.625 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 . . . . . 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.474 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.474 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.41 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.585 HD22 HD21 ' A' ' 30' ' ' LEU . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.457 HG23 HG23 ' A' ' 46' ' ' THR . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.498 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.498 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.504 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.489 HD21 HD22 ' C' ' 140' ' ' LEU . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB3' HD12 ' A' ' 36' ' ' ILE . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.486 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.493 HG23 HG23 ' C' ' 149' ' ' ILE . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.15 0.5 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HE3' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.419 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.488 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.496 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 30' ' ' LEU . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.493 HG23 HG23 ' A' ' 46' ' ' THR . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.511 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.511 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.517 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' A' ' 36' ' ' ILE . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.426 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.517 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.498 HG23 HG23 ' C' ' 149' ' ' ILE . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.427 ' CD2' HD13 ' C' ' 140' ' ' LEU . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 120.84 0.352 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.501 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.501 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.489 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' C' ' 133' ' ' LEU . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 53' ' ' PHE . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 46' ' ' THR . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 . . . . . 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.491 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.491 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.498 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.422 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.406 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.504 HG23 HG23 ' C' ' 149' ' ' ILE . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 121.358 0.599 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.413 HG22 HG13 ' C' ' 159' ' ' ILE . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.608 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.608 HD21 ' HB3' ' B' ' 104' ' ' GLU . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 36' ' ' ILE . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.504 HG23 HG23 ' A' ' 46' ' ' THR . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 159' ' ' ILE . . . . . 0.413 HG13 HG22 ' B' ' 101' ' ' ILE . 9.7 mm . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.675 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.485 HG23 HG23 ' C' ' 149' ' ' ILE . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 121.101 0.477 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.412 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.476 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.675 HD22 HD11 ' A' ' 30' ' ' LEU . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.485 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm . . . . . 0 CA--C 1.55 0.961 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 . . . . . 0 CA--C 1.535 0.398 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.517 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.523 ' HB3' HD21 ' C' ' 133' ' ' LEU . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.628 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 36' ' ' ILE . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.407 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.506 HG23 HG23 ' C' ' 149' ' ' ILE . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.034 0.445 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.457 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 29' ' ' ASN . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 30' ' ' LEU . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 46' ' ' THR . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.488 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.488 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.488 HD21 HD23 ' A' ' 41' ' ' LEU . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.417 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 25' ' ' PRO . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.406 HD21 HD22 ' C' ' 140' ' ' LEU . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.452 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.488 HD23 HD21 ' A' ' 20' ' ' LEU . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.499 HG23 HG23 ' C' ' 149' ' ' ILE . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.902 0.382 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.483 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.483 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.465 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.406 HD22 HD21 ' A' ' 30' ' ' LEU . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.499 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm . . . . . 0 CA--C 1.558 1.282 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 120.555 0.217 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.547 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.697 HD11 HD22 ' C' ' 140' ' ' LEU . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.428 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.676 HG23 HG23 ' C' ' 149' ' ' ILE . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 73' ' ' LYS . . . . . 0.502 ' HG2' HG23 ' B' ' 98' ' ' THR . 33.4 mtmt . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.059 0.457 . . . . 0.0 111.493 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 98' ' ' THR . . . . . 0.502 HG23 ' HG2' ' B' ' 73' ' ' LYS . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.459 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.459 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.442 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.442 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 30' ' ' LEU . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.676 HG23 HG23 ' A' ' 46' ' ' THR . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 . . . . . 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.513 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 27' ' ' LEU . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.464 HD21 HD22 ' C' ' 140' ' ' LEU . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HB3' HD12 ' A' ' 36' ' ' ILE . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD21 ' CD2' ' A' ' 31' ' ' PHE . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.425 ' HB3' ' HB ' ' A' ' 46' ' ' THR . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.497 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.622 HG23 HG23 ' C' ' 149' ' ' ILE . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt . . . . . 0 N--CA 1.471 0.625 0 CA-C-O 121.185 0.517 . . . . 0.0 112.084 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.49 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.49 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.44 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.464 HD22 HD21 ' A' ' 30' ' ' LEU . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.622 HG23 HG23 ' A' ' 46' ' ' THR . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo . . . . . 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.429 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' C' ' 133' ' ' LEU . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.701 HD21 HD22 ' C' ' 140' ' ' LEU . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.494 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.477 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.523 HG23 HG23 ' C' ' 149' ' ' ILE . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.551 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t . . . . . 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 121.222 0.534 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 . . . . . 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.437 HG22 HG13 ' C' ' 159' ' ' ILE . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.467 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.414 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.44 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.701 HD22 HD21 ' A' ' 30' ' ' LEU . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.523 HG23 HG23 ' A' ' 46' ' ' THR . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 159' ' ' ILE . . . . . 0.437 HG13 HG22 ' B' ' 101' ' ' ILE . 13.4 mm . . . . . 0 CA--C 1.557 1.249 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.515 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 23' ' ' LEU . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.491 HD21 HD22 ' C' ' 140' ' ' LEU . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.531 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.496 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.531 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.496 HG23 HG23 ' C' ' 149' ' ' ILE . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.985 0.422 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.509 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.496 HD21 HD11 ' A' ' 36' ' ' ILE . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.496 HG23 HG23 ' A' ' 46' ' ' THR . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm . . . . . 0 CA--C 1.56 1.343 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.508 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.508 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD21 HD23 ' A' ' 41' ' ' LEU . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.77 HD11 HD22 ' C' ' 140' ' ' LEU . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.49 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.476 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.601 HG23 HG23 ' C' ' 149' ' ' ILE . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' C' ' 140' ' ' LEU . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 73' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' B' ' 98' ' ' THR . 23.2 mtmm . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.695 0.284 . . . . 0.0 111.311 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' B' ' 86' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 98' ' ' THR . . . . . 0.435 HG23 ' HG2' ' B' ' 73' ' ' LYS . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.481 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.481 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.432 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.446 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.77 HD22 HD11 ' A' ' 30' ' ' LEU . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.601 HG23 HG23 ' A' ' 46' ' ' THR . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 . . . . . 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.553 1.078 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.504 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 81.8 t90 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.569 0.223 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.49 HD22 ' H ' ' A' ' 20' ' ' LEU . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.75 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.455 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.487 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.589 HG23 HG23 ' C' ' 149' ' ' ILE . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.922 0.391 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.47 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.47 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.446 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.75 HD22 HD11 ' A' ' 30' ' ' LEU . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.589 HG23 HG23 ' A' ' 46' ' ' THR . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm . . . . . 0 CA--C 1.553 1.081 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.0 t90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.471 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HD22 ' C' ' 140' ' ' LEU . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.464 HD11 HD21 ' C' ' 140' ' ' LEU . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.484 HG23 HG23 ' C' ' 149' ' ' ILE . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.708 0.29 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.402 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.471 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.471 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.464 HD21 HD11 ' A' ' 36' ' ' ILE . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.484 HG23 HG23 ' A' ' 46' ' ' THR . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 . . . . . 0 CA--C 1.539 0.524 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CD1' HD22 ' A' ' 41' ' ' LEU . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.445 HD21 HD22 ' C' ' 140' ' ' LEU . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.506 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 18' ' ' PHE . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.424 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.46 HG23 HG23 ' C' ' 149' ' ' ILE . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' C' ' 140' ' ' LEU . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.632 0.73 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 . . . . . 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.476 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.476 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.405 ' CE1' HG22 ' B' ' 115' ' ' VAL . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.405 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' HD23 ' B' ' 109' ' ' LEU . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 36' ' ' ILE . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.46 HG23 HG23 ' A' ' 46' ' ' THR . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 . . . . . 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.552 1.025 0 CA-C-O 119.509 -0.281 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 HD22 ' C' ' 140' ' ' LEU . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.401 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.502 HG23 HG23 ' C' ' 149' ' ' ILE . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.108 0.48 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.429 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 123' ' ' PRO . . . . . 0.406 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' C' ' 133' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.579 HD22 HD11 ' A' ' 30' ' ' LEU . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.502 HG23 HG23 ' A' ' 46' ' ' THR . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.497 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.497 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 168' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.508 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HB3' HD12 ' A' ' 36' ' ' ILE . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.466 HG23 HG23 ' C' ' 149' ' ' ILE . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 121.412 0.625 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 . . . . . 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 121.361 0.6 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.51 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 123' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.472 ' HB2' HD12 ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.466 HG23 HG23 ' A' ' 46' ' ' THR . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.47 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.47 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 168' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 27' ' ' LEU . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.437 ' HB2' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.435 HD21 HD22 ' C' ' 140' ' ' LEU . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.513 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.48 ' CE ' HD22 ' C' ' 133' ' ' LEU . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.513 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.532 HG23 HG23 ' C' ' 149' ' ' ILE . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.456 0.646 . . . . 0.0 112.361 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.486 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.408 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.504 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.48 HD22 ' CE ' ' A' ' 33' ' ' MET . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.435 HD22 HD21 ' A' ' 30' ' ' LEU . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.532 HG23 HG23 ' A' ' 46' ' ' THR . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.558 1.273 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.593 HD21 HD22 ' C' ' 140' ' ' LEU . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.405 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.4 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.629 HG23 HG23 ' C' ' 149' ' ' ILE . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 73' ' ' LYS . . . . . 0.453 ' HG2' HG23 ' B' ' 98' ' ' THR . 24.6 mtmt . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 98' ' ' THR . . . . . 0.453 HG23 ' HG2' ' B' ' 73' ' ' LYS . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.552 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' B' ' 104' ' ' GLU . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 133' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' C' ' 133' ' ' LEU . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 30' ' ' LEU . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.629 HG23 HG23 ' A' ' 46' ' ' THR . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm . . . . . 0 CA--C 1.55 0.969 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo . . . . . 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.619 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.514 ' CD2' HD21 ' A' ' 41' ' ' LEU . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.514 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.474 HG23 HG23 ' C' ' 149' ' ' ILE . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.896 0.379 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 104' ' ' GLU . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 113' ' ' HIS . . . . . 0.451 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 122' ' ' PHE . . . . . 0.423 ' CE1' HG21 ' B' ' 127' ' ' THR . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 123' ' ' PRO . . . . . 0.405 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 124' ' ' SER . . . . . 0.466 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.423 HG21 ' CE1' ' B' ' 122' ' ' PHE . 18.9 p . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 140' ' ' LEU . . . . . 0.619 HD22 HD11 ' A' ' 30' ' ' LEU . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 149' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 46' ' ' THR . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? . . . . . 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 168' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -144.37 160.62 40.74 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.791 1.236 . . . . 0.0 112.519 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -145.11 165.98 26.71 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.81 1.644 . . . . 0.0 111.741 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -66.59 171.32 5.19 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.476 1.288 . . . . 0.0 114.476 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.26 -67.58 0.98 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.676 1.59 . . . . 0.0 112.657 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -14.8 63.26 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.7 pt -142.49 -171.8 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 128.058 2.543 . . . . 0.0 109.101 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.66 -29.24 4.51 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.579 1.085 . . . . 0.0 111.624 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -57.34 -43.99 83.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.81 1.644 . . . . 0.0 113.342 170.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.56 129.33 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.614 0.766 . . . . 0.0 110.386 177.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.86 97.06 1.46 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 107.236 -2.346 . . . . 0.0 107.236 169.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -139.58 147.89 41.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.291 1.836 . . . . 0.0 110.908 170.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.465 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.585 HD21 HD22 ' C' ' 140' ' ' LEU . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.525 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.4 HD11 HD21 ' C' ' 140' ' ' LEU . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.525 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.457 HG23 HG23 ' C' ' 149' ' ' ILE . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t -71.46 -30.09 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -33.43 75.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.046 1.338 . . . . 0.0 113.521 173.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 125.515 1.526 . . . . 0.0 113.024 177.913 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.556 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.5 t -147.69 161.0 42.08 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.265 1.826 . . . . 0.0 111.606 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -151.38 -167.13 2.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.619 1.568 . . . . 0.0 111.926 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 66.8 mtp -41.53 128.71 3.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.554 1.942 . . . . 0.0 113.596 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -71.75 152.91 42.36 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.474 1.11 . . . . 0.0 111.644 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -69.89 -45.67 67.13 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.117 0.967 . . . . 0.0 112.093 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -68.74 126.04 28.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.227 1.011 . . . . 0.0 111.999 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -137.22 166.7 23.13 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.474 1.11 . . . . 0.0 111.515 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -148.34 156.65 42.77 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 48.3 m -139.01 118.97 13.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.458 1.503 . . . . 0.0 111.292 -170.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.09 -51.41 25.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.33 -158.31 31.35 Favored Glycine 0 CA--C 1.543 1.787 0 O-C-N 121.286 -0.884 . . . . 0.0 113.297 -162.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.2 m -74.13 82.93 1.8 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.765 1.226 . . . . 0.0 112.968 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.93 -23.19 0.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 172.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 58.55 9.74 1.19 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 126.853 2.061 . . . . 0.0 115.922 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.474 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.474 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.41 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -137.71 163.99 29.95 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -141.66 153.0 44.42 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.723 1.209 . . . . 0.0 110.723 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.83 160.28 12.3 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.178 0.99 . . . . 0.0 113.17 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 62.7 mt -115.94 23.41 12.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.119 1.768 . . . . 0.0 111.742 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -58.2 166.29 1.67 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.931 0.892 . . . . 0.0 113.235 162.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.773 2.029 . . . . 0.0 114.269 -175.26 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.585 HD22 HD21 ' A' ' 30' ' ' LEU . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.457 HG23 HG23 ' A' ' 46' ' ' THR . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 -61.63 -14.42 30.62 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -134.08 45.99 2.56 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.228 1.411 . . . . 0.0 113.142 -166.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 ptp -130.71 146.44 52.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.859 1.264 . . . . 0.0 112.076 176.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.19 168.57 26.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.373 1.869 . . . . 0.0 111.38 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.26 -179.03 2.7 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 172.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -126.18 174.91 8.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.106 2.563 . . . . 0.0 110.698 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm -117.0 133.42 23.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 123.934 0.894 . . . . 0.0 110.582 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.498 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.498 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -69.26 167.39 23.91 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -68.76 75.21 0.85 Allowed 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 124.786 3.658 . . . . 0.0 112.707 174.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.2 t -136.88 117.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 125.786 1.635 . . . . 0.0 108.257 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -151.76 168.93 23.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.418 1.087 . . . . 0.0 112.984 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -73.79 176.59 6.18 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.648 1.179 . . . . 0.0 112.055 168.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -131.85 125.14 31.05 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.509 1.524 . . . . 0.0 109.28 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.7 139.65 49.81 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 112.709 -172.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 70.2 m -136.4 145.43 45.31 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.488 1.115 . . . . 0.0 111.987 -175.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -61.92 156.22 58.3 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.318 1.447 . . . . 0.0 112.944 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--O 1.255 1.326 0 C-N-CA 123.796 2.997 . . . . 0.0 113.5 177.894 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -74.29 164.24 26.85 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.132 0.973 . . . . 0.0 112.7 174.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -137.47 176.11 9.0 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.057 1.743 . . . . 0.0 111.736 -178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -130.76 171.29 13.29 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.781 1.632 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -113.89 -69.31 0.87 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.748 1.619 . . . . 0.0 112.152 -175.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.55 -14.41 62.49 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 pt -141.61 -167.91 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.907 2.483 . . . . 0.0 109.074 -177.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.12 -10.46 40.04 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 123.809 0.719 . . . . 0.0 113.127 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -81.07 -34.24 32.84 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.524 1.93 . . . . 0.0 113.725 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.35 -29.71 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.741 1.617 . . . . 0.0 115.141 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 71.27 22.44 78.54 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.86 1.219 . . . . 0.0 115.727 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -80.49 147.05 31.05 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.895 1.348 . . . . 0.0 111.698 175.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.504 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.489 HD21 HD22 ' C' ' 140' ' ' LEU . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB3' HD12 ' A' ' 36' ' ' ILE . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.486 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.493 HG23 HG23 ' C' ' 149' ' ' ILE . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t -69.47 -29.85 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.94 -31.14 71.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.052 1.341 . . . . 0.0 113.795 173.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.374 1.47 . . . . 0.0 113.076 -179.748 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 67.1 p 42.74 46.23 4.37 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 126.924 2.09 . . . . 0.0 115.746 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.33 161.85 35.89 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.876 1.27 . . . . 0.0 113.397 -177.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 3.5 ptm -68.68 172.82 5.8 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.605 1.962 . . . . 0.0 113.751 171.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? 59.11 14.84 3.7 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 126.771 2.028 . . . . 0.0 115.04 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -97.36 -23.83 15.92 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.794 1.237 . . . . 0.0 113.924 177.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -150.03 130.67 14.01 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.642 1.177 . . . . 0.0 110.2 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -134.47 167.67 20.35 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.784 1.233 . . . . 0.0 110.504 174.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -143.19 142.1 31.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 22.9 m -117.52 104.3 10.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.302 1.441 . . . . 0.0 110.049 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.15 -26.77 67.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.189 1.396 . . . . 0.0 113.768 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.95 -88.66 0.97 Allowed Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.882 1.23 . . . . 0.0 114.135 173.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.9 t -145.16 35.07 1.09 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 112.329 -173.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -113.48 164.38 13.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.685 1.594 . . . . 0.0 111.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HE3' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -121.11 9.2 10.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.64 1.576 . . . . 0.0 113.664 -178.512 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.419 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.488 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.496 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p -138.6 167.33 22.17 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -142.14 150.23 40.82 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.335 1.054 . . . . 0.0 110.599 169.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.09 151.94 17.74 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.414 1.085 . . . . 0.0 111.67 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.3 mt -107.25 13.97 26.62 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.106 1.363 . . . . 0.0 112.191 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.78 -25.28 63.73 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--O 1.253 1.289 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 178.25 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 30' ' ' LEU . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.493 HG23 HG23 ' A' ' 46' ' ' THR . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -59.36 -13.05 6.9 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -140.21 63.51 1.47 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.101 1.76 . . . . 0.0 111.71 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 7.9 ptp -148.3 151.87 36.14 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.937 1.295 . . . . 0.0 112.566 173.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -163.36 167.94 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 112.36 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -139.05 157.04 46.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.964 1.306 . . . . 0.0 113.116 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.57 171.44 10.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.675 1.59 . . . . 0.0 112.722 168.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -125.7 135.24 26.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 125.207 1.403 . . . . 0.0 110.001 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.511 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.511 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.03 169.27 15.34 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -71.25 72.65 2.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.091 3.861 . . . . 0.0 112.176 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 11.7 p -138.68 -19.06 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.987 1.315 . . . . 0.0 113.62 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -113.11 20.04 16.64 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.756 1.622 . . . . 0.0 112.559 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -109.79 164.13 12.85 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.55 1.94 . . . . 0.0 112.276 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.2 125.85 25.87 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.666 1.187 . . . . 0.0 112.181 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -71.02 154.7 41.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.893 0.877 . . . . 0.0 112.1 173.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 24.7 t -145.31 143.76 30.36 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.124 1.37 . . . . 0.0 110.632 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 41.41 63.92 5.78 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 126.525 1.93 . . . . 0.0 112.738 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 123.919 3.079 . . . . 0.0 113.182 -178.733 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 t -72.45 -22.27 61.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.198 0.999 . . . . 0.0 113.545 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -133.94 159.66 40.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.397 1.479 . . . . 0.0 111.809 -175.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.0 174.55 9.14 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.897 1.279 . . . . 0.0 113.976 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -118.94 -68.24 0.93 Allowed 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.819 1.648 . . . . 0.0 112.35 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.21 -15.89 63.76 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.3 pt -138.46 -162.88 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 128.207 2.603 . . . . 0.0 108.722 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.03 30.26 4.0 Favored Glycine 0 CA--C 1.536 1.369 0 O-C-N 121.595 -0.69 . . . . 0.0 112.495 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -136.52 -54.28 0.73 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.738 1.615 . . . . 0.0 111.323 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.449 HG11 ' HE1' ' A' ' 51' ' ' TYR . 13.5 p -52.87 136.32 13.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 126.989 2.116 . . . . 0.0 112.456 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.86 79.55 0.25 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 125.462 1.506 . . . . 0.0 109.957 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -123.99 150.78 44.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 0.0 112.917 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.517 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' A' ' 36' ' ' ILE . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.426 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.517 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.498 HG23 HG23 ' C' ' 149' ' ' ILE . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.449 ' HE1' HG11 ' A' ' 10' ' ' VAL . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.427 ' CD2' HD13 ' C' ' 140' ' ' LEU . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t -69.25 -24.75 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.79 -24.04 67.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.966 1.306 . . . . 0.0 114.207 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 125.633 1.573 . . . . 0.0 112.785 177.406 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.1 p 52.12 36.78 19.9 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.132 1.373 . . . . 0.0 113.512 -166.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -63.27 -11.26 20.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.577 1.551 . . . . 0.0 114.373 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.1 ptp -126.28 119.94 28.69 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.949 1.7 . . . . 0.0 109.425 170.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -65.56 160.62 22.02 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.638 0.775 . . . . 0.0 111.169 172.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -71.79 19.88 0.06 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 126.155 1.782 . . . . 0.0 114.639 172.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -145.03 136.47 25.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.12 1.768 . . . . 0.0 110.493 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -136.75 170.37 16.19 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.455 1.502 . . . . 0.0 111.106 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -147.26 147.94 30.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.0 m -131.88 118.13 19.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.47 1.508 . . . . 0.0 109.761 -172.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.09 85.86 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -171.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.14 85.94 0.05 OUTLIER Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.202 0.906 . . . . 0.0 114.401 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t 60.23 38.06 20.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.984 1.314 . . . . 0.0 113.929 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -133.83 154.77 50.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.379 1.471 . . . . 0.0 112.034 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt -126.87 6.13 6.64 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.912 1.685 . . . . 0.0 113.335 -176.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.501 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.501 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.489 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p -130.02 174.52 9.69 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -149.02 148.39 29.68 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.587 1.155 . . . . 0.0 111.156 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.47 144.52 36.39 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.636 0.775 . . . . 0.0 111.191 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.3 mt -95.7 11.11 34.56 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.438 1.095 . . . . 0.0 112.011 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -55.54 131.87 47.24 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.17 0.988 . . . . 0.0 113.078 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.111 1.365 . . . . 0.0 114.621 -178.625 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' C' ' 133' ' ' LEU . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 53' ' ' PHE . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 46' ' ' THR . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -63.36 -17.96 63.16 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.89 -20.59 57.93 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -108.96 138.48 45.25 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.075 1.35 . . . . 0.0 111.006 -177.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.14 -177.95 6.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.484 1.513 . . . . 0.0 111.479 -176.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -140.0 169.83 16.98 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.409 1.483 . . . . 0.0 112.399 173.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -103.01 173.4 6.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.383 1.873 . . . . 0.0 111.486 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -113.42 133.42 22.15 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.299 1.04 . . . . 0.0 109.796 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.491 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.491 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.57 165.48 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.25 76.81 1.3 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 125.0 3.8 . . . . 0.0 112.081 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.7 t -136.48 146.59 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.667 1.587 . . . . 0.0 109.097 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -137.04 172.1 13.51 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.207 1.403 . . . . 0.0 111.78 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -141.63 148.03 38.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.413 1.085 . . . . 0.0 111.436 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -154.85 168.78 25.76 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.882 1.673 . . . . 0.0 111.577 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -63.3 161.04 14.61 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.158 0.983 . . . . 0.0 112.269 173.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 82.3 p -117.71 37.48 3.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.535 1.534 . . . . 0.0 112.349 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 47.99 64.14 9.09 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.13 2.172 . . . . 0.0 113.301 -176.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.207 3.271 . . . . 0.0 113.277 -178.604 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -148.41 165.63 30.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.86 1.264 . . . . 0.0 112.637 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.2 p30 -151.85 176.0 11.89 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.775 1.63 . . . . 0.0 112.594 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.52 167.38 5.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.76 -68.12 0.95 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.43 1.492 . . . . 0.0 112.69 -176.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.33 -16.37 64.22 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 177.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.5 pt -137.66 -162.04 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 128.041 2.536 . . . . 0.0 108.611 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 106.1 30.71 4.37 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.543 -0.723 . . . . 0.0 112.407 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -137.49 -50.32 0.61 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.877 1.671 . . . . 0.0 111.611 -172.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG11 ' HE1' ' A' ' 51' ' ' TYR . 7.6 p -55.82 146.88 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 126.699 1.999 . . . . 0.0 112.395 174.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -117.93 85.87 0.4 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.484 1.516 . . . . 0.0 109.632 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 -131.23 150.22 52.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.015 0.926 . . . . 0.0 113.145 171.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.498 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.422 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.406 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.504 HG23 HG23 ' C' ' 149' ' ' ILE . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.486 ' HE1' HG11 ' A' ' 10' ' ' VAL . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.29 -26.72 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -17.26 51.26 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.86 -0.496 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.7 p -68.71 -27.13 65.67 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -88.66 4.52 46.87 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.942 1.697 . . . . 0.0 114.268 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 8.8 ptp -132.79 99.51 4.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.837 1.255 . . . . 0.0 111.654 -176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -125.08 54.14 1.46 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.454 2.302 . . . . 0.0 110.798 -166.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -172.93 2.74 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.376 2.27 . . . . 0.0 110.646 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -54.1 139.04 36.36 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.161 0.985 . . . . 0.0 112.352 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -133.76 165.68 24.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.722 1.209 . . . . 0.0 111.505 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -148.94 153.14 37.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 59.6 m -141.63 124.1 15.8 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.587 1.555 . . . . 0.0 110.376 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.68 67.09 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.55 72.05 0.74 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.037 0.827 . . . . 0.0 114.817 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 1.5 t 76.65 34.33 0.46 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.05 1.74 . . . . 0.0 113.977 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -129.4 145.4 51.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.427 1.491 . . . . 0.0 111.384 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 5.84 25.69 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.897 1.679 . . . . 0.0 112.728 177.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.413 HG22 HG13 ' C' ' 159' ' ' ILE . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.608 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.608 HD21 ' HB3' ' B' ' 104' ' ' GLU . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p -135.75 163.97 28.96 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -139.42 145.58 39.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.512 1.125 . . . . 0.0 110.888 172.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.2 pp -55.24 152.66 7.92 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.941 1.296 . . . . 0.0 113.238 175.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.0 11.15 18.94 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.581 1.552 . . . . 0.0 112.276 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -64.54 121.17 13.79 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.695 0.798 . . . . 0.0 111.069 170.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.255 1.352 0 C-N-CA 125.534 1.534 . . . . 0.0 112.688 -176.568 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 36' ' ' ILE . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.504 HG23 HG23 ' A' ' 46' ' ' THR . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -65.49 -21.1 66.6 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.9 -39.84 19.33 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 -173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.4 ptp -64.78 155.18 34.67 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.949 0.9 . . . . 0.0 111.829 167.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.47 178.34 10.41 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.39 . . . . 0.0 112.096 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -138.49 159.79 41.2 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.829 1.651 . . . . 0.0 111.991 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.11 -50.73 6.79 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 -171.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 159' ' ' ILE . . . . . 0.413 HG13 HG22 ' B' ' 101' ' ' ILE . 9.7 mm 62.9 133.63 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 127.247 2.219 . . . . 0.0 113.479 -170.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 165.21 30.28 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.24 71.24 2.33 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 125.159 3.906 . . . . 0.0 112.359 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.1 t -137.32 147.19 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.642 1.577 . . . . 0.0 109.138 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -132.54 159.66 38.8 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.082 1.353 . . . . 0.0 111.351 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -66.95 104.61 1.41 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.366 1.067 . . . . 0.0 111.498 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -150.69 117.66 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.23 1.412 . . . . 0.0 110.22 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -72.75 161.8 30.29 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.27 1.028 . . . . 0.0 112.397 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -110.34 1.27 18.36 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.114 1.366 . . . . 0.0 114.396 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -141.53 71.41 25.89 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.874 1.67 . . . . 0.0 110.47 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.254 1.275 0 C-N-CA 123.847 3.031 . . . . 0.0 113.019 178.271 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.556 -0.58 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -161.11 149.57 16.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.06 1.344 . . . . 0.0 111.48 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -146.83 166.11 27.68 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.275 1.83 . . . . 0.0 111.52 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -62.52 166.29 5.38 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 172.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.608 1.563 . . . . 0.0 112.447 -177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -14.43 62.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 pt -142.1 -171.55 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 127.759 2.424 . . . . 0.0 109.269 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.97 -28.63 7.22 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.262 0.934 . . . . 0.0 112.095 173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -59.86 -31.13 69.48 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.35 1.86 . . . . 0.0 114.068 173.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.62 -21.64 22.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -164.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.8 18.85 54.39 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 126.403 1.954 . . . . 0.0 117.131 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 -77.02 148.41 36.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.526 1.163 . . . . 0.0 111.965 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.675 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.485 HG23 HG23 ' C' ' 149' ' ' ILE . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.35 -27.34 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -10.69 58.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.58 1.952 . . . . 0.0 115.059 175.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 125.51 1.524 . . . . 0.0 112.775 -178.201 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 60.8 p -111.93 149.58 31.7 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.811 1.245 . . . . 0.0 111.706 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -157.14 161.48 39.37 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.259 1.424 . . . . 0.0 110.308 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 7.8 ptp -56.18 134.08 52.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.262 1.025 . . . . 0.0 113.122 176.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -137.04 10.72 3.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 126.801 2.04 . . . . 0.0 113.042 -176.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.39 -41.61 63.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.194 1.397 . . . . 0.0 113.345 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -164.92 139.24 5.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.589 1.956 . . . . 0.0 109.427 170.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -133.92 163.45 29.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.785 1.234 . . . . 0.0 110.866 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -145.73 147.17 31.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 14.0 t -124.12 130.94 53.41 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.762 1.225 . . . . 0.0 111.25 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.53 65.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 54.87 49.31 62.57 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 115.065 0.786 . . . . 0.0 115.065 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.6 t 77.02 51.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.232 1.813 . . . . 0.0 113.47 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -136.13 161.43 35.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.246 1.418 . . . . 0.0 112.521 177.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -116.78 -4.19 11.64 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 126.089 1.756 . . . . 0.0 113.322 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.412 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.476 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p -136.18 165.3 26.04 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -140.24 147.69 40.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.47 1.108 . . . . 0.0 110.679 170.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.13 145.66 36.06 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.109 0.964 . . . . 0.0 111.756 175.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.85 10.2 40.78 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.79 1.236 . . . . 0.0 112.096 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -55.92 140.17 43.76 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.221 1.009 . . . . 0.0 113.051 171.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.254 1.31 0 C-N-CA 125.184 1.393 . . . . 0.0 112.976 -175.422 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.675 HD22 HD11 ' A' ' 30' ' ' LEU . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.485 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -72.5 -7.3 49.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -118.25 26.86 9.33 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.626 1.57 . . . . 0.0 112.162 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.1 ptp -141.5 139.64 33.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.578 1.551 . . . . 0.0 110.774 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -164.04 -174.82 3.74 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.879 1.671 . . . . 0.0 110.701 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -139.06 168.58 19.51 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.133 1.373 . . . . 0.0 112.461 171.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -101.82 171.37 7.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.026 1.73 . . . . 0.0 112.052 177.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm -122.35 133.81 24.56 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.689 1.196 . . . . 0.0 109.558 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.96 165.35 26.46 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -71.67 68.59 2.91 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 125.292 3.995 . . . . 0.0 112.4 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 64.4 t -136.46 148.68 27.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.672 1.589 . . . . 0.0 108.907 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -119.25 149.65 41.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.575 1.15 . . . . 0.0 111.627 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -104.29 -15.65 15.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.971 0.908 . . . . 0.0 112.675 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 46.45 42.3 10.61 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.336 1.855 . . . . 0.0 113.267 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -122.11 152.25 40.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.093 1.357 . . . . 0.0 112.389 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 22.5 t -160.86 146.17 14.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.107 1.363 . . . . 0.0 110.544 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 40.71 56.18 7.81 Favored Pre-proline 0 N--CA 1.483 1.216 0 C-N-CA 126.659 1.984 . . . . 0.0 114.167 175.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--O 1.256 1.403 0 C-N-CA 124.152 3.234 . . . . 0.0 113.618 -174.935 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -58.8 130.98 49.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.512 1.125 . . . . 0.0 112.777 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -112.52 89.23 3.01 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.223 1.409 . . . . 0.0 109.992 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -138.06 171.58 14.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.445 1.498 . . . . 0.0 112.515 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -118.02 -67.09 1.02 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.569 1.548 . . . . 0.0 112.16 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -15.54 63.51 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 177.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.63 -170.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 127.847 2.459 . . . . 0.0 109.238 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.97 -27.51 4.06 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.734 1.159 . . . . 0.0 111.818 172.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.9 -36.5 74.78 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.016 1.726 . . . . 0.0 113.672 170.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.9 t -77.92 128.69 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.687 1.195 . . . . 0.0 109.996 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.47 26.1 21.04 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.741 1.639 . . . . 0.0 114.681 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -67.03 150.14 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.971 1.308 . . . . 0.0 111.995 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.517 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.523 ' HB3' HD21 ' C' ' 133' ' ' LEU . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.628 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 36' ' ' ILE . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.407 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.506 HG23 HG23 ' C' ' 149' ' ' ILE . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t -69.53 -28.23 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.52 -21.53 66.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.634 1.573 . . . . 0.0 114.758 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.43 1.492 . . . . 0.0 113.699 -175.948 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.9 p -138.92 62.95 1.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.878 1.271 . . . . 0.0 112.198 -174.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -59.75 175.59 0.36 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.46 1.104 . . . . 0.0 113.114 168.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 17.5 ptp -49.18 173.11 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.548 1.539 . . . . 0.0 113.863 163.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.14 -19.34 2.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.541 1.536 . . . . 0.0 114.246 177.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 tttp 70.71 36.08 1.67 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 127.853 2.461 . . . . 0.0 111.861 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -149.86 132.65 15.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.71 1.204 . . . . 0.0 110.362 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -134.05 166.84 21.81 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.302 1.441 . . . . 0.0 109.887 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -148.2 153.08 38.29 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 90.5 m -139.97 118.51 12.25 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.484 1.514 . . . . 0.0 110.705 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.1 -32.43 73.88 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -176.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.36 -77.8 0.72 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.499 1.523 . . . . 0.0 115.046 178.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.5 p -138.76 14.0 2.7 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.403 1.481 . . . . 0.0 114.193 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -110.33 160.32 16.66 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.327 1.451 . . . . 0.0 111.979 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -118.0 12.56 13.72 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.382 1.873 . . . . 0.0 112.843 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.457 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p -132.34 175.87 8.9 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.39 152.72 33.48 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.254 1.021 . . . . 0.0 111.698 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.52 146.18 36.43 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 112.061 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.07 14.4 29.4 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.888 1.275 . . . . 0.0 111.67 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -58.94 154.7 14.77 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 171.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.826 1.65 . . . . 0.0 113.868 -177.291 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 29' ' ' ASN . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 30' ' ' LEU . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 46' ' ' THR . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.58 -16.61 2.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -116.33 20.21 14.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.885 1.674 . . . . 0.0 111.847 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 39.9 mtm -118.06 126.43 52.25 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.948 1.299 . . . . 0.0 112.1 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.31 157.87 26.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.351 1.46 . . . . 0.0 111.517 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.2 170.75 19.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.091 1.356 . . . . 0.0 113.167 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -99.73 175.6 5.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.675 1.99 . . . . 0.0 112.636 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm -122.85 135.25 25.59 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.234 1.413 . . . . 0.0 109.661 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.488 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.488 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.73 167.57 20.82 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.17 70.58 1.79 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 125.188 3.925 . . . . 0.0 112.633 174.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 79.8 t -126.57 -30.54 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.674 1.19 . . . . 0.0 112.694 -175.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.22 135.31 38.42 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.675 1.19 . . . . 0.0 112.61 174.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -158.01 153.32 25.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.311 1.045 . . . . 0.0 111.378 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -72.78 105.63 4.42 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.09 0.956 . . . . 0.0 110.908 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -64.24 132.1 49.31 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.415 0.686 . . . . 0.0 111.943 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 51.8 m -149.59 149.9 31.39 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.764 1.625 . . . . 0.0 110.803 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? 37.55 59.87 4.27 Favored Pre-proline 0 N--CA 1.483 1.219 0 C-N-CA 126.868 2.067 . . . . 0.0 113.802 -177.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo . . . . . 0 C--O 1.253 1.265 0 C-N-CA 123.702 2.935 . . . . 0.0 113.061 -178.838 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -75.68 53.34 0.71 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.241 1.817 . . . . 0.0 113.107 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -131.9 27.62 4.57 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.452 1.901 . . . . 0.0 111.823 -170.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -137.31 175.02 9.98 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.611 1.964 . . . . 0.0 112.323 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -115.92 -63.23 1.48 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.062 1.345 . . . . 0.0 112.972 -176.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -15.23 63.44 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 177.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.1 pt -141.61 -176.93 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.009 2.524 . . . . 0.0 109.309 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.28 -31.25 1.95 Allowed Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.659 1.123 . . . . 0.0 111.301 170.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.47 -48.52 80.49 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.458 1.903 . . . . 0.0 114.372 175.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.6 t -64.48 129.82 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.072 0.949 . . . . 0.0 111.096 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.95 30.12 11.07 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.216 1.389 . . . . 0.0 114.448 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -75.64 150.05 38.05 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.052 0.926 . . . . 0.0 112.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.488 HD21 HD23 ' A' ' 41' ' ' LEU . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.417 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 25' ' ' PRO . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.406 HD21 HD22 ' C' ' 140' ' ' LEU . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.452 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.488 HD23 HD21 ' A' ' 20' ' ' LEU . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.499 HG23 HG23 ' C' ' 149' ' ' ILE . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m -79.21 -18.84 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -78.46 -40.48 35.45 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.427 1.491 . . . . 0.0 112.386 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.645 1.578 . . . . 0.0 113.232 178.675 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.466 -0.653 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.7 t -151.63 165.13 35.26 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.192 1.397 . . . . 0.0 111.208 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -110.56 -13.32 14.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.5 mmt -78.18 143.3 37.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.956 0.902 . . . . 0.0 111.77 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -132.56 4.21 3.93 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.429 1.492 . . . . 0.0 113.905 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -68.0 -70.95 0.23 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.804 1.242 . . . . 0.0 111.935 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -167.24 151.25 6.7 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.487 1.915 . . . . 0.0 109.751 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -135.44 163.31 30.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.236 1.014 . . . . 0.0 111.65 173.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -144.5 151.77 39.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 40.7 m -133.65 111.7 10.83 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.422 1.489 . . . . 0.0 110.61 -169.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.46 -20.93 62.03 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.33 -102.46 0.67 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.367 0.984 . . . . 0.0 113.176 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 39.4 m -124.4 4.4 8.39 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.03 1.332 . . . . 0.0 113.927 -173.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -78.16 165.41 23.98 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.269 1.028 . . . . 0.0 112.435 176.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -123.33 11.2 9.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.796 1.638 . . . . 0.0 113.258 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.483 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.483 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.465 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p -132.05 -178.71 5.02 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 9.8 ptmm? -145.08 -89.79 0.1 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' LEU . . . . . 0.454 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 2.1 pt? -164.46 171.13 15.06 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.039 2.136 . . . . 0.0 111.415 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 19.2 mt -137.17 31.94 2.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.316 1.846 . . . . 0.0 111.47 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.53 161.49 9.56 Favored 'General case' 0 CA--C 1.552 1.039 0 O-C-N 121.512 -0.742 . . . . 0.0 111.77 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . 0.253 11.3 pt-20 . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 126.84 2.056 . . . . 0.0 115.293 -171.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.406 HD22 HD21 ' A' ' 30' ' ' LEU . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.499 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -62.94 -12.47 25.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -89.03 3.61 51.09 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -142.43 80.82 1.72 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 112.181 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.99 179.75 7.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.059 1.744 . . . . 0.0 112.093 174.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -55.56 147.57 17.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.326 1.45 . . . . 0.0 114.545 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -50.95 44.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm 63.88 133.15 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 127.313 2.245 . . . . 0.0 113.606 -172.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.04 169.57 14.77 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -71.68 78.71 1.65 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.723 3.616 . . . . 0.0 111.302 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.9 p -142.8 152.63 17.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 125.374 1.469 . . . . 0.0 110.587 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 3.7 pp0? -146.39 163.47 35.5 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.484 1.514 . . . . 0.0 111.542 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -66.86 108.51 2.57 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.877 0.871 . . . . 0.0 111.449 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.83 -13.17 62.24 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -112.78 158.86 19.59 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.723 1.609 . . . . 0.0 110.571 169.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -142.23 166.09 25.64 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.719 1.207 . . . . 0.0 112.367 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.38 147.28 49.16 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.504 1.121 . . . . 0.0 113.353 -178.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 C--O 1.252 1.197 0 C-N-CA 123.882 3.055 . . . . 0.0 113.091 177.86 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t 47.45 45.24 17.18 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 127.059 2.144 . . . . 0.0 116.038 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -123.76 36.28 4.66 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.755 1.622 . . . . 0.0 112.087 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -136.91 173.44 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.577 1.551 . . . . 0.0 113.274 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -118.05 -65.85 1.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.531 1.533 . . . . 0.0 112.706 -175.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -15.58 63.67 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 176.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.8 pt -142.0 -172.78 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 128.232 2.613 . . . . 0.0 108.946 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.64 -27.94 4.3 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.587 1.089 . . . . 0.0 111.568 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.85 -42.96 90.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.929 1.692 . . . . 0.0 113.594 171.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.73 133.48 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 123.91 0.884 . . . . 0.0 110.639 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.72 84.05 0.36 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.354 1.93 . . . . 0.0 109.238 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -129.67 148.3 51.54 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.348 1.459 . . . . 0.0 111.384 175.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.547 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.697 HD11 HD22 ' C' ' 140' ' ' LEU . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.428 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.676 HG23 HG23 ' C' ' 149' ' ' ILE . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.07 -28.5 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.05 -8.1 46.6 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.831 2.052 . . . . 0.0 115.102 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 m120 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.697 1.999 . . . . 0.0 113.545 -175.076 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 44.1 m -80.28 -34.5 36.88 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -88.91 149.91 23.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.481 1.112 . . . . 0.0 111.723 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 44.2 mtp 61.45 110.39 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.62 2.368 . . . . 0.0 113.566 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -94.52 44.01 1.1 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.222 1.809 . . . . 0.0 112.497 -172.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -135.92 160.02 39.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.808 2.043 . . . . 0.0 110.621 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -59.21 142.89 50.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.451 0.7 . . . . 0.0 110.691 175.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LYS . . . . . 0.502 ' HG2' HG23 ' B' ' 98' ' ' THR . 33.4 mtmt -126.76 159.7 33.01 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.608 0.763 . . . . 0.0 111.493 176.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -145.3 153.96 41.83 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 15.4 t -127.25 133.85 50.15 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.857 1.263 . . . . 0.0 112.084 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.74 -14.37 58.78 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.438 1.095 . . . . 0.0 113.63 176.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 55.7 -108.54 1.1 Allowed Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.237 0.923 . . . . 0.0 112.566 -170.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 45.8 m -110.71 0.98 17.62 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.22 1.408 . . . . 0.0 114.039 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -82.46 161.16 22.51 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.02 0.928 . . . . 0.0 112.711 -176.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -118.05 8.23 12.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.885 1.674 . . . . 0.0 113.171 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' THR . . . . . 0.502 HG23 ' HG2' ' B' ' 73' ' ' LYS . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.459 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.459 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.442 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.442 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p -133.94 173.18 11.84 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -133.24 -88.89 0.41 Allowed 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.5 -0.75 . . . . 0.0 111.844 174.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.1 pp -166.76 174.3 8.77 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.163 1.785 . . . . 0.0 111.506 -174.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.9 mt -132.92 17.9 4.17 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.7 1.6 . . . . 0.0 112.862 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -63.48 119.78 10.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.055 0.942 . . . . 0.0 111.425 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 125.285 1.434 . . . . 0.0 112.85 178.033 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 30' ' ' LEU . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.676 HG23 HG23 ' A' ' 46' ' ' THR . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -63.75 -12.48 35.42 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -107.76 64.37 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.171 1.389 . . . . 0.0 111.135 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 mmt -130.42 -176.34 3.93 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.188 2.195 . . . . 0.0 110.309 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.55 123.18 16.02 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.348 -0.845 . . . . 0.0 112.179 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -143.56 -55.1 0.38 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.842 1.257 . . . . 0.0 112.471 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.26 176.75 1.99 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.688 1.995 . . . . 0.0 110.49 -171.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm -113.2 134.24 21.91 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 124.38 1.072 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.11 169.69 16.08 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.39 78.69 1.54 Allowed 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.784 3.656 . . . . 0.0 111.467 174.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.6 p -144.05 148.12 18.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.265 1.426 . . . . 0.0 110.542 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.39 155.19 42.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.055 1.342 . . . . 0.0 111.149 174.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -151.13 -33.4 0.15 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -74.14 119.09 17.87 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.437 -0.789 . . . . 0.0 109.864 167.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -60.21 142.09 54.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 12.4 t -159.53 156.27 27.86 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.502 1.521 . . . . 0.0 110.806 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 32.1 mtm-85 60.2 158.41 0.11 Allowed Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 127.947 2.499 . . . . 0.0 115.072 -174.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 C--O 1.254 1.277 0 C-N-CA 123.663 2.909 . . . . 0.0 113.211 -179.72 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -125.83 -5.18 6.92 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -76.91 163.92 26.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.081 0.952 . . . . 0.0 112.546 174.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -146.72 173.82 12.01 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.365 1.466 . . . . 0.0 112.906 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -114.79 -68.48 0.92 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.602 1.561 . . . . 0.0 112.149 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -14.89 63.1 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.2 pt -141.34 -174.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.565 2.346 . . . . 0.0 109.535 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.15 -25.13 4.39 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.541 1.067 . . . . 0.0 111.94 171.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -64.01 -34.98 79.24 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.568 1.947 . . . . 0.0 114.493 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.26 158.43 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.424 1.09 . . . . 0.0 111.519 -177.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.65 30.34 4.47 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.121 1.343 . . . . 0.0 114.054 -175.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -83.84 151.06 25.35 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.187 0.994 . . . . 0.0 112.639 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.513 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 27' ' ' LEU . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.464 HD21 HD22 ' C' ' 140' ' ' LEU . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HB3' HD12 ' A' ' 36' ' ' ILE . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD21 ' CD2' ' A' ' 31' ' ' PHE . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.425 ' HB3' ' HB ' ' A' ' 46' ' ' THR . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.497 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.622 HG23 HG23 ' C' ' 149' ' ' ILE . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t -72.96 -29.02 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -34.45 77.2 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 171.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.17 1.388 . . . . 0.0 113.146 -176.829 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.535 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.6 p -144.26 136.57 26.54 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.465 1.106 . . . . 0.0 112.139 175.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -87.21 -16.56 34.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.625 1.17 . . . . 0.0 113.325 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.0 mtp -139.35 179.2 6.68 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.006 1.722 . . . . 0.0 111.492 -174.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.73 13.27 6.9 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.761 1.625 . . . . 0.0 113.222 -177.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' B' ' 71' ' ' LYS . 8.5 mmpt? -95.99 165.49 12.23 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.78 1.632 . . . . 0.0 111.204 173.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -60.67 150.1 33.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.158 0.983 . . . . 0.0 111.809 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -124.84 164.67 19.52 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.064 0.945 . . . . 0.0 112.084 170.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -144.89 153.3 41.43 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 51.5 m -139.32 112.88 8.36 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.314 1.446 . . . . 0.0 110.226 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.14 69.23 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.71 -124.98 34.18 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.094 -1.004 . . . . 0.0 112.458 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.7 m -90.22 14.31 12.96 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -169.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -111.98 160.27 17.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.689 1.196 . . . . 0.0 113.202 -175.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -122.81 9.72 9.5 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.129 1.772 . . . . 0.0 113.856 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.49 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.49 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.44 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p -137.13 166.78 22.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -141.05 151.36 43.98 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.906 1.282 . . . . 0.0 110.437 170.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -64.17 158.95 21.66 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.212 1.006 . . . . 0.0 113.051 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.24 23.85 12.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.36 1.864 . . . . 0.0 111.533 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.08 -30.39 70.31 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 166.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.749 1.619 . . . . 0.0 115.136 -179.133 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.464 HD22 HD21 ' A' ' 30' ' ' LEU . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.622 HG23 HG23 ' A' ' 46' ' ' THR . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -59.92 -5.02 0.85 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -129.6 39.65 3.69 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.936 1.695 . . . . 0.0 112.328 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 29.1 mtm -130.36 92.93 3.36 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.256 1.423 . . . . 0.0 111.537 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.31 168.94 25.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.001 1.32 . . . . 0.0 112.421 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -140.65 165.43 27.5 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.126 1.37 . . . . 0.0 112.619 -176.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -76.07 174.89 9.47 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.623 1.969 . . . . 0.0 112.665 169.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm -122.09 134.93 24.96 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 125.145 1.378 . . . . 0.0 109.969 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.48 169.71 15.11 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 79.94 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.733 3.622 . . . . 0.0 111.523 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.0 p -143.77 148.85 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.538 1.535 . . . . 0.0 110.269 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -142.8 -47.06 0.32 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.2 1.0 . . . . 0.0 112.491 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -74.17 90.61 2.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.269 1.028 . . . . 0.0 111.132 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.31 68.37 0.75 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.806 1.642 . . . . 0.0 112.024 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -57.68 158.93 5.6 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.2 1.4 . . . . 0.0 112.474 173.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 30.4 t -136.71 142.97 43.12 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.95 1.3 . . . . 0.0 110.505 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 47.2 ptt85 -57.87 154.84 25.8 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.943 1.297 . . . . 0.0 112.737 173.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.255 1.332 0 C-N-CA 123.468 2.778 . . . . 0.0 112.838 169.29 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.519 -0.6 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 m -66.18 -27.97 68.41 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -109.49 172.0 7.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.746 1.618 . . . . 0.0 111.229 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -58.89 164.87 2.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -111.98 -65.76 1.15 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.306 1.443 . . . . 0.0 112.342 -173.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.21 63.27 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 176.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.7 pt -141.7 -171.86 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 127.701 2.401 . . . . 0.0 109.068 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.05 -28.23 7.39 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.159 0.885 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -58.86 -33.77 70.85 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.209 1.804 . . . . 0.0 114.06 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 p -69.95 -21.28 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -164.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.37 56.3 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.994 1.759 . . . . 0.0 117.123 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -77.64 148.58 34.98 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.566 1.183 . . . . 0.0 112.078 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.429 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' C' ' 133' ' ' LEU . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.701 HD21 HD22 ' C' ' 140' ' ' LEU . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.494 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.477 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.523 HG23 HG23 ' C' ' 149' ' ' ILE . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.551 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t -66.67 -25.23 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.77 -16.74 64.47 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 172.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 51.0 t30 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 126.102 1.761 . . . . 0.0 113.775 -167.886 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 CA-C-O 121.255 0.364 . . . . 0.0 112.231 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 74.5 p -137.09 54.72 1.85 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.815 1.646 . . . . 0.0 111.068 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -140.49 176.42 8.79 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.53 1.932 . . . . 0.0 112.114 -172.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 33.4 mtt 59.57 -171.9 0.12 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.977 1.711 . . . . 0.0 113.954 -177.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -124.67 162.25 24.55 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.797 1.639 . . . . 0.0 112.071 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.56 21.73 0.1 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.244 1.818 . . . . 0.0 115.41 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -138.18 131.58 30.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.018 1.327 . . . . 0.0 111.478 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -140.44 170.12 16.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.545 1.538 . . . . 0.0 111.271 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -143.51 138.36 29.14 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -112.37 103.87 12.0 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.175 1.39 . . . . 0.0 109.958 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.17 67.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.198 1.399 . . . . 0.0 114.186 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 60.66 -140.63 48.04 Favored Glycine 0 CA--C 1.536 1.358 0 O-C-N 121.317 -0.864 . . . . 0.0 113.267 -176.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 17.2 m -73.68 -3.73 30.01 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -174.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -77.85 161.35 27.68 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -118.01 5.27 12.08 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 126.129 1.772 . . . . 0.0 113.284 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.437 HG22 HG13 ' C' ' 159' ' ' ILE . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.467 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.414 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.44 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p -131.55 168.82 17.02 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -139.88 144.86 37.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.496 1.118 . . . . 0.0 110.39 169.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.71 148.63 28.7 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.042 0.937 . . . . 0.0 111.389 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 27.4 mt -108.02 17.52 22.28 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.324 1.45 . . . . 0.0 111.839 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 152.84 13.76 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.307 1.043 . . . . 0.0 113.321 167.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--O 1.256 1.406 0 C-N-CA 127.331 2.252 . . . . 0.0 115.066 -175.319 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.701 HD22 HD21 ' A' ' 30' ' ' LEU . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.523 HG23 HG23 ' A' ' 46' ' ' THR . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 -69.82 -11.38 60.81 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 -109.6 30.73 6.38 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.771 1.628 . . . . 0.0 111.952 -175.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 36.8 mtt -102.29 119.99 39.74 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.899 1.28 . . . . 0.0 111.114 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.7 172.03 19.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.606 1.962 . . . . 0.0 110.907 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 157' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' C' ' 159' ' ' ILE . 1.1 pm0 -123.59 158.88 30.45 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.989 1.316 . . . . 0.0 112.564 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 -52.28 5.82 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 159' ' ' ILE . . . . . 0.454 HD11 ' HG3' ' C' ' 157' ' ' GLU . 13.4 mm 64.38 133.98 0.04 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 127.524 2.33 . . . . 0.0 113.638 -173.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.11 167.37 20.23 Favored 'Trans proline' 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.08 72.07 1.63 Allowed 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 124.984 3.789 . . . . 0.0 112.389 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 60.0 t -137.75 148.07 25.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 125.96 1.704 . . . . 0.0 108.85 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -123.95 104.1 8.71 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.824 1.25 . . . . 0.0 109.812 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -67.54 -21.15 65.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.707 1.203 . . . . 0.0 114.059 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -64.59 119.03 9.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.481 1.112 . . . . 0.0 111.046 173.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -59.61 151.81 23.78 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.704 0.764 . . . . 0.0 112.831 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 67.3 m -139.31 168.38 19.95 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.428 1.891 . . . . 0.0 111.254 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 11.7 tpp85 76.78 133.49 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 128.955 2.902 . . . . 0.0 111.896 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 C--O 1.252 1.21 0 C-N-CA 123.446 2.764 . . . . 0.0 113.148 175.559 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.466 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t -151.42 162.83 40.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.486 1.515 . . . . 0.0 111.385 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -139.0 161.64 36.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.916 1.686 . . . . 0.0 111.983 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -67.96 171.46 6.73 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.65 1.18 . . . . 0.0 114.096 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.67 -65.06 1.22 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.612 1.565 . . . . 0.0 112.883 -177.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -16.33 64.03 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 177.258 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.9 pt -141.92 -171.24 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 128.176 2.59 . . . . 0.0 108.822 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.9 -25.95 6.01 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.427 1.013 . . . . 0.0 111.901 173.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -55.38 -48.91 73.59 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.767 1.627 . . . . 0.0 112.42 168.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.416 HG11 ' HE1' ' A' ' 51' ' ' TYR . 7.8 p -62.71 136.72 25.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 111.678 -178.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.78 82.92 0.32 Allowed Glycine 0 CA--C 1.521 0.422 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -129.43 150.02 50.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.821 0.849 . . . . 0.0 112.911 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.515 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 23' ' ' LEU . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.491 HD21 HD22 ' C' ' 140' ' ' LEU . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.531 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.496 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.531 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.496 HG23 HG23 ' C' ' 149' ' ' ILE . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HE1' HG11 ' A' ' 10' ' ' VAL . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m -76.28 -18.57 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -41.42 75.29 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.868 0.867 . . . . 0.0 112.606 171.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 124.964 1.306 . . . . 0.0 112.586 -176.78 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.9 p -80.11 54.25 1.9 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.187 1.795 . . . . 0.0 113.913 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -138.26 152.55 48.67 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.797 1.639 . . . . 0.0 111.547 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.4 mtp 48.57 33.87 4.48 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.735 1.614 . . . . 0.0 114.754 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.0 8.69 4.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.331 1.853 . . . . 0.0 114.883 -172.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -51.07 -40.73 59.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.494 1.517 . . . . 0.0 112.464 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -157.92 135.33 10.31 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.907 1.283 . . . . 0.0 110.526 166.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp -131.05 171.06 13.67 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.345 1.458 . . . . 0.0 110.464 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -144.54 145.94 32.1 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 60.9 m -124.15 108.78 12.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.43 1.492 . . . . 0.0 110.122 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -34.27 76.8 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.937 1.295 . . . . 0.0 114.304 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.28 -141.8 45.06 Favored Glycine 0 CA--C 1.538 1.519 0 O-C-N 121.022 -1.049 . . . . 0.0 112.62 -169.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -71.58 4.33 3.2 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -172.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -98.42 150.4 21.66 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.782 1.174 . . . . 0.0 113.028 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.47 4.11 20.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.794 1.638 . . . . 0.0 113.816 -174.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.509 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p -136.54 168.39 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -141.04 150.33 42.84 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.669 1.188 . . . . 0.0 110.386 169.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' LEU . . . . . 0.523 ' H ' HD23 ' B' ' 129' ' ' LEU . 1.7 pt? -55.52 163.76 1.2 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.787 1.235 . . . . 0.0 113.841 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 39.7 mt -128.8 26.12 5.58 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.044 1.738 . . . . 0.0 111.898 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -63.07 156.69 24.15 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 121.58 -0.7 . . . . 0.0 112.174 169.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.388 1.475 . . . . 0.0 114.413 -178.638 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.496 HD21 HD11 ' A' ' 36' ' ' ILE . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.496 HG23 HG23 ' A' ' 46' ' ' THR . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.52 -25.13 64.23 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -134.5 72.46 1.46 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.987 2.115 . . . . 0.0 110.272 -172.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 10.8 mtt -97.65 152.31 19.21 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.723 0.809 . . . . 0.0 111.774 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.11 141.21 18.4 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.005 1.322 . . . . 0.0 111.661 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -144.49 155.62 43.79 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.139 1.376 . . . . 0.0 112.642 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.37 -52.02 9.84 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm 64.06 133.21 0.03 OUTLIER Pre-proline 0 CA--C 1.56 1.343 0 C-N-CA 127.213 2.205 . . . . 0.0 113.671 -172.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.508 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.508 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 166.4 23.07 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.31 78.56 0.85 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.768 3.646 . . . . 0.0 112.127 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.6 t -138.57 137.68 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 125.782 1.633 . . . . 0.0 108.806 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -126.68 149.38 49.58 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.78 1.232 . . . . 0.0 110.867 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -68.14 -23.56 64.9 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -87.54 -16.86 33.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -76.57 172.55 12.83 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.318 1.047 . . . . 0.0 112.338 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 4.8 t -129.05 44.91 2.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.605 1.562 . . . . 0.0 111.29 -177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -136.15 152.36 75.21 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 126.601 1.96 . . . . 0.0 111.903 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.243 3.295 . . . . 0.0 113.529 -177.988 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -144.09 122.97 12.71 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.964 1.306 . . . . 0.0 110.142 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -153.56 -43.84 0.09 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.306 1.042 . . . . 0.0 112.713 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -149.44 175.17 11.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.855 1.662 . . . . 0.0 112.299 174.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -121.88 -64.91 1.17 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.69 1.596 . . . . 0.0 112.606 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.34 -15.63 63.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.0 pt -142.05 -172.79 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 128.008 2.523 . . . . 0.0 108.913 -178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 127.21 -21.88 5.71 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.343 0.973 . . . . 0.0 112.196 173.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -61.67 -40.5 95.15 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.672 1.589 . . . . 0.0 113.219 171.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.48 158.57 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.315 1.046 . . . . 0.0 111.24 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.01 56.94 0.73 Allowed Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.973 1.273 . . . . 0.0 112.361 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -103.52 150.56 23.79 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 118.364 1.082 . . . . 0.0 112.276 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD21 HD23 ' A' ' 41' ' ' LEU . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.77 HD11 HD22 ' C' ' 140' ' ' LEU . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.49 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.476 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.601 HG23 HG23 ' C' ' 149' ' ' ILE . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' C' ' 140' ' ' LEU . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.58 -29.57 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -9.91 47.86 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.149 1.78 . . . . 0.0 115.154 172.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 128.22 2.608 . . . . 0.0 114.494 178.24 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.752 0 N-CA-C 112.107 -0.397 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.5 m -74.89 -17.13 60.62 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -112.93 -149.16 0.44 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.653 1.581 . . . . 0.0 109.422 176.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 45.6 mmm -67.08 161.62 24.09 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.948 -1.095 . . . . 0.0 111.539 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -58.63 154.85 13.58 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.994 0.918 . . . . 0.0 112.679 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -59.96 158.15 11.38 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.917 0.887 . . . . 0.0 111.769 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 73.83 105.51 0.07 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.436 2.294 . . . . 0.0 111.495 -171.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' B' ' 98' ' ' THR . 23.2 mtmm -132.87 164.65 26.43 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.608 1.163 . . . . 0.0 111.311 176.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -144.13 149.38 36.43 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 88.1 m -134.4 118.34 17.32 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.534 1.534 . . . . 0.0 110.08 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.37 79.87 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.54 57.55 8.94 Favored Glycine 0 CA--C 1.537 1.464 0 O-C-N 121.433 -0.792 . . . . 0.0 113.891 178.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 18.8 m 68.81 45.9 0.95 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.647 1.579 . . . . 0.0 114.321 176.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -120.64 164.92 15.79 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.761 1.625 . . . . 0.0 111.931 176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' B' ' 86' ' ' LYS . 0.1 OUTLIER -123.33 9.14 9.11 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 125.679 1.592 . . . . 0.0 113.932 -177.448 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' THR . . . . . 0.435 HG23 ' HG2' ' B' ' 73' ' ' LYS . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.481 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.481 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.432 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.446 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p -132.38 172.67 12.16 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -134.13 -85.25 0.43 Allowed 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.402 -0.811 . . . . 0.0 112.144 174.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -166.6 174.77 8.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.537 1.935 . . . . 0.0 111.566 -174.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.4 mt -132.93 22.17 4.17 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.725 1.61 . . . . 0.0 112.752 174.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -60.9 162.36 7.0 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.972 0.909 . . . . 0.0 112.254 166.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.567 1.947 . . . . 0.0 114.066 -175.731 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.77 HD22 HD11 ' A' ' 30' ' ' LEU . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.601 HG23 HG23 ' A' ' 46' ' ' THR . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 -57.03 -12.11 1.9 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -128.92 33.27 4.64 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.149 1.779 . . . . 0.0 111.626 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 30.5 mtm -130.01 158.58 39.21 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 112.43 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.85 179.65 8.89 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 111.97 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.52 161.77 40.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.466 1.506 . . . . 0.0 113.461 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.6 p-80 -85.99 176.08 8.24 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.919 1.688 . . . . 0.0 112.465 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -125.53 136.05 27.78 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 125.375 1.47 . . . . 0.0 109.839 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.504 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.27 166.58 24.76 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.31 70.64 1.86 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.001 3.8 . . . . 0.0 112.551 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.45 93.55 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.089 1.355 . . . . 0.0 109.359 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -142.32 172.09 13.16 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.652 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -56.38 150.21 15.27 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.129 0.972 . . . . 0.0 112.613 172.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -79.93 126.71 31.36 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.65 0.78 . . . . 0.0 110.915 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -107.95 -43.04 4.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.766 0.826 . . . . 0.0 113.04 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 38.5 m -148.19 -34.61 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -172.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -118.36 153.1 51.62 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.287 1.835 . . . . 0.0 110.393 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.882 3.055 . . . . 0.0 113.015 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -74.4 66.8 1.38 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.534 1.934 . . . . 0.0 113.994 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -133.56 177.59 7.58 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.223 1.809 . . . . 0.0 111.917 -178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -124.53 176.86 6.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.009 1.724 . . . . 0.0 112.743 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -111.44 -77.09 0.59 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.754 1.621 . . . . 0.0 111.935 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -15.82 28.01 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.1 pt -138.05 -9.59 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 125.968 1.707 . . . . 0.0 113.587 -172.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -85.63 -20.9 55.37 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 123.866 0.746 . . . . 0.0 113.297 178.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -53.89 -30.07 44.43 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.969 1.308 . . . . 0.0 113.039 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.485 HG13 ' H ' ' A' ' 12' ' ' TRP . 0.7 OUTLIER -69.77 -20.75 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.648 1.979 . . . . 0.0 114.437 -177.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.56 27.02 53.78 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.382 1.468 . . . . 0.0 116.261 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.485 ' H ' HG13 ' A' ' 10' ' ' VAL . 81.8 t90 -81.38 146.29 30.39 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.908 1.354 . . . . 0.0 111.559 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.49 HD22 ' H ' ' A' ' 20' ' ' LEU . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.75 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.455 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.487 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.589 HG23 HG23 ' C' ' 149' ' ' ILE . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -65.97 -24.28 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -14.45 49.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.179 1.392 . . . . 0.0 114.642 173.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.1 t30 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 126.639 1.976 . . . . 0.0 113.893 -171.856 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 CA-C-O 121.158 0.31 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.5 t 52.35 36.82 20.79 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 126.297 1.839 . . . . 0.0 115.169 175.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -92.38 19.71 6.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.269 1.428 . . . . 0.0 113.722 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 79.0 mtp -130.84 163.99 26.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.898 1.679 . . . . 0.0 111.835 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -58.07 133.52 55.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.6 1.16 . . . . 0.0 110.301 174.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -67.09 31.59 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.641 2.376 . . . . 0.0 116.812 -174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -128.39 112.74 14.74 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.194 1.397 . . . . 0.0 110.164 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm -133.44 161.92 33.26 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.919 0.887 . . . . 0.0 111.47 178.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -140.56 131.78 26.53 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 23.3 m -103.46 97.0 7.12 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.145 1.378 . . . . 0.0 110.163 -179.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -24.68 66.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.972 1.309 . . . . 0.0 114.074 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.15 -143.24 48.33 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.185 -0.947 . . . . 0.0 113.136 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.7 p -74.25 -3.75 31.93 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -69.37 161.33 29.59 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -176.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -120.53 5.07 10.63 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.413 1.885 . . . . 0.0 114.024 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.47 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.47 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.446 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p -137.04 171.87 13.85 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.1 -83.18 0.47 Allowed 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 172.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.1 pp -168.17 172.55 8.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.117 1.767 . . . . 0.0 111.681 -171.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.0 mt -135.43 15.51 3.44 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.629 1.571 . . . . 0.0 113.127 173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -70.14 -11.15 60.68 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.698 1.999 . . . . 0.0 112.595 -177.855 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.75 HD22 HD11 ' A' ' 30' ' ' LEU . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.589 HG23 HG23 ' A' ' 46' ' ' THR . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -7.92 19.46 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.96 2.04 53.22 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.672 1.189 . . . . 0.0 112.521 171.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.1 mtm -121.61 26.14 8.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.651 1.58 . . . . 0.0 112.606 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.54 -173.05 3.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.95 2.1 . . . . 0.0 111.256 -174.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.25 156.81 14.67 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 172.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -73.59 171.25 13.57 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.481 1.513 . . . . 0.0 112.738 167.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm -129.04 136.36 29.06 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.526 1.531 . . . . 0.0 109.925 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.81 166.98 22.56 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.8 62.27 3.07 Favored 'Trans proline' 0 CA--C 1.543 0.939 1 C-N-CA 125.304 4.003 . . . . 0.0 113.127 177.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 38.2 t -138.06 144.3 31.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.212 1.405 . . . . 0.0 109.553 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -132.13 44.52 2.89 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.141 1.376 . . . . 0.0 111.897 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -72.44 176.54 5.28 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.993 1.317 . . . . 0.0 113.585 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 37.9 mp0 -130.95 161.05 32.76 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.537 1.535 . . . . 0.0 111.773 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -61.55 159.55 12.87 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 48.2 m -147.57 173.95 12.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.346 1.458 . . . . 0.0 112.574 176.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -130.38 153.94 81.42 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.062 2.145 . . . . 0.0 111.053 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.954 3.103 . . . . 0.0 113.137 178.237 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -155.14 -174.01 4.8 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.113 1.365 . . . . 0.0 111.763 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -133.35 35.0 3.47 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.667 1.987 . . . . 0.0 112.258 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -141.63 177.16 8.34 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.894 1.678 . . . . 0.0 113.094 -172.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -116.16 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.608 1.563 . . . . 0.0 111.676 -179.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.65 -4.3 6.04 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -138.52 -31.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 125.458 1.503 . . . . 0.0 113.874 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.32 -24.81 61.82 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.955 1.264 . . . . 0.0 114.699 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -66.76 -39.85 88.04 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.705 0.802 . . . . 0.0 112.862 169.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 12' ' ' TRP . 0.5 OUTLIER -64.63 157.81 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 126.887 2.075 . . . . 0.0 111.157 178.826 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.34 31.42 4.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.889 1.233 . . . . 0.0 113.655 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.499 ' H ' HG13 ' A' ' 10' ' ' VAL . 77.0 t90 -82.74 149.26 27.38 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.547 -0.972 . . . . 0.0 112.334 -178.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.471 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HD22 ' C' ' 140' ' ' LEU . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.464 HD11 HD21 ' C' ' 140' ' ' LEU . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.484 HG23 HG23 ' C' ' 149' ' ' ILE . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.5 -28.64 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -24.79 67.54 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 173.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 125.288 1.435 . . . . 0.0 112.434 -176.283 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -147.3 34.01 0.88 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.692 1.197 . . . . 0.0 112.789 -170.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -114.97 122.63 46.85 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.103 1.361 . . . . 0.0 110.191 -177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 86.2 mtp 50.18 35.77 11.02 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 123.402 1.573 . . . . 0.0 114.579 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -101.23 37.56 1.75 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.913 2.485 . . . . 0.0 111.951 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.26 179.54 0.1 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.413 1.485 . . . . 0.0 111.165 165.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -50.81 133.54 26.22 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.757 -0.59 . . . . 0.0 111.022 172.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm -126.47 163.54 23.11 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.912 0.885 . . . . 0.0 110.901 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -143.82 150.2 38.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 53.0 m -137.55 111.59 8.39 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.336 1.455 . . . . 0.0 110.017 -173.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.7 -39.4 65.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.572 1.549 . . . . 0.0 115.036 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.07 69.42 1.37 Allowed Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.295 -0.878 . . . . 0.0 112.809 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 16.2 m 63.0 27.73 16.01 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.518 1.527 . . . . 0.0 115.048 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -112.16 152.89 27.81 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.121 1.369 . . . . 0.0 112.313 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.14 -2.71 14.88 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.82 1.648 . . . . 0.0 114.082 -175.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.402 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.471 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.471 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -134.99 171.62 14.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -132.55 -86.79 0.45 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.257 0.623 . . . . 0.0 112.143 173.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 pp -166.22 173.62 9.98 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.246 1.819 . . . . 0.0 111.645 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -134.32 18.88 3.68 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.707 1.603 . . . . 0.0 112.584 173.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.23 155.87 19.92 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.075 0.95 . . . . 0.0 111.908 166.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.871 2.068 . . . . 0.0 114.445 -173.336 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.464 HD21 HD11 ' A' ' 36' ' ' ILE . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.484 HG23 HG23 ' A' ' 46' ' ' THR . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -52.66 -24.79 9.2 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -74.04 -12.46 60.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.816 1.646 . . . . 0.0 114.002 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 2.1 ptm -152.59 52.11 0.77 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.473 1.509 . . . . 0.0 112.22 -165.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -146.09 174.18 11.53 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.331 1.453 . . . . 0.0 112.954 -175.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -118.93 160.37 22.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.774 1.23 . . . . 0.0 113.34 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -72.35 174.34 7.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.703 2.001 . . . . 0.0 112.877 169.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm -123.87 134.84 25.65 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 125.209 1.404 . . . . 0.0 110.154 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.97 167.23 22.17 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -68.76 78.17 0.72 Allowed 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.707 3.605 . . . . 0.0 112.19 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.0 t -138.79 142.63 33.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.678 1.591 . . . . 0.0 109.416 -177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -146.45 -178.64 6.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.572 1.549 . . . . 0.0 111.636 -178.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -55.53 144.23 26.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.903 0.881 . . . . 0.0 112.198 175.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 53.28 43.46 31.45 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -170.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -54.09 149.6 9.22 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.662 1.185 . . . . 0.0 114.024 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.7 p -159.61 160.94 34.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.239 1.416 . . . . 0.0 111.964 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -147.57 71.27 11.67 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 125.05 1.34 . . . . 0.0 111.304 174.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 123.61 2.874 . . . . 0.0 112.944 176.838 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.2 m 51.22 34.76 11.97 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.043 1.737 . . . . 0.0 115.197 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -67.12 -21.11 65.86 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.664 1.186 . . . . 0.0 114.0 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -142.55 174.25 10.8 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.302 1.841 . . . . 0.0 111.61 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -119.62 -61.9 1.56 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.234 1.413 . . . . 0.0 112.646 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -16.8 64.5 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.2 pt -142.29 -177.17 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 127.941 2.496 . . . . 0.0 109.67 -176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 132.98 -24.63 3.79 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.496 1.046 . . . . 0.0 112.086 171.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -63.59 -46.77 84.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.022 1.729 . . . . 0.0 114.226 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.66 156.69 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 124.93 1.292 . . . . 0.0 111.726 -176.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.04 31.72 4.41 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.067 1.318 . . . . 0.0 114.442 -175.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -77.71 149.22 34.61 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.58 -0.953 . . . . 0.0 112.583 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CD1' HD22 ' A' ' 41' ' ' LEU . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.445 HD21 HD22 ' C' ' 140' ' ' LEU . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.506 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 18' ' ' PHE . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.424 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.46 HG23 HG23 ' C' ' 149' ' ' ILE . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' C' ' 140' ' ' LEU . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t -75.79 -30.03 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.79 -31.6 71.59 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 169.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.1 t30 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 124.814 1.246 . . . . 0.0 113.329 -175.182 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.074 -0.41 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 34.5 t -152.19 152.06 31.77 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.954 1.301 . . . . 0.0 111.986 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -94.93 -4.2 47.23 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.295 1.438 . . . . 0.0 113.404 173.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 43.0 mtp -77.59 178.58 7.16 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.659 1.184 . . . . 0.0 112.495 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.27 167.71 2.33 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.109 1.364 . . . . 0.0 113.771 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.54 10.05 35.2 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 126.546 1.938 . . . . 0.0 114.991 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -122.78 15.21 10.12 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.562 1.545 . . . . 0.0 115.127 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -62.61 167.42 4.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.843 0.857 . . . . 0.0 112.619 -170.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -141.05 136.16 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 39.6 m -106.27 98.0 7.74 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.531 1.532 . . . . 0.0 110.312 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.17 66.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.017 1.327 . . . . 0.0 114.245 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.42 49.58 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.378 -0.826 . . . . 0.0 113.39 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.6 p -75.87 -0.58 21.8 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.85 166.83 10.47 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -120.45 0.65 10.57 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.344 1.458 . . . . 0.0 114.335 -176.789 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.476 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.476 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.405 ' CE1' HG22 ' B' ' 115' ' ' VAL . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.405 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' HD23 ' B' ' 109' ' ' LEU . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p -131.07 -171.91 2.7 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.441 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 0.3 OUTLIER -150.3 -88.23 0.07 Allowed 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.221 -0.924 . . . . 0.0 112.544 177.763 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 129' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 0.0 OUTLIER -153.3 -175.23 5.25 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.784 2.433 . . . . 0.0 110.436 178.497 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.8 mt -133.19 19.33 4.04 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 169.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -57.3 158.13 5.75 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.81 2.044 . . . . 0.0 115.911 -168.891 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 36' ' ' ILE . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.46 HG23 HG23 ' A' ' 46' ' ' THR . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 -62.67 -12.33 22.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 31.0 m120 -131.15 70.97 1.46 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.681 1.992 . . . . 0.0 110.868 -176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 14.3 mtp -128.13 107.04 9.48 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.877 1.271 . . . . 0.0 111.706 -177.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.24 152.04 21.81 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.802 1.241 . . . . 0.0 112.225 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -163.27 166.44 23.14 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.382 1.473 . . . . 0.0 113.443 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -87.68 176.63 7.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.603 1.961 . . . . 0.0 112.711 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm -121.62 134.78 24.7 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.189 1.396 . . . . 0.0 110.251 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.15 165.86 27.03 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.02 79.49 1.02 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.585 3.523 . . . . 0.0 111.899 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 58.3 t -137.87 106.25 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.127 1.371 . . . . 0.0 109.267 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -151.78 -159.34 1.01 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.968 1.707 . . . . 0.0 110.462 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.99 99.71 0.37 Allowed 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.018 -1.052 . . . . 0.0 111.445 171.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -112.37 158.72 19.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.179 1.791 . . . . 0.0 111.567 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.89 -33.73 62.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.714 0.805 . . . . 0.0 112.911 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 89.5 p 42.76 32.1 0.36 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.949 2.499 . . . . 0.0 116.47 -176.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 62.31 149.71 0.1 OUTLIER Pre-proline 0 N--CA 1.486 1.336 0 C-N-CA 128.949 2.899 . . . . 0.0 114.632 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo . . . . . 0 C--O 1.254 1.305 0 C-N-CA 123.7 2.934 . . . . 0.0 113.191 177.906 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -149.01 54.48 0.98 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.688 1.595 . . . . 0.0 111.449 -174.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -134.82 170.59 15.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.211 1.805 . . . . 0.0 112.716 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -66.78 166.09 13.86 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -110.68 -68.35 0.93 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.46 1.504 . . . . 0.0 112.437 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.03 -14.6 63.13 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 pt -141.07 -167.67 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 127.475 2.31 . . . . 0.0 109.271 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.01 -33.76 2.87 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.15 1.357 . . . . 0.0 110.706 171.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -57.5 -25.72 60.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.49 2.316 . . . . 0.0 115.315 172.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.7 t -78.55 -36.17 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.945 0.898 . . . . 0.0 113.417 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.96 26.99 63.93 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.957 1.265 . . . . 0.0 116.043 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -79.51 148.86 31.66 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.694 1.247 . . . . 0.0 112.039 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 HD22 ' C' ' 140' ' ' LEU . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.401 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.502 HG23 HG23 ' C' ' 149' ' ' ILE . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t -73.08 -32.29 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.95 -25.58 63.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.202 1.801 . . . . 0.0 114.122 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 124.93 1.292 . . . . 0.0 112.813 174.121 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 76.3 p -146.01 150.15 35.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.786 1.234 . . . . 0.0 112.461 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -71.97 -42.1 66.92 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.168 0.587 . . . . 0.0 111.5 170.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 65.9 mtp -82.8 166.61 18.86 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.583 1.153 . . . . 0.0 111.908 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -49.06 146.53 3.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.974 1.709 . . . . 0.0 113.672 174.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.84 58.91 4.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.692 1.597 . . . . 0.0 112.018 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -146.53 112.78 5.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.898 1.279 . . . . 0.0 110.71 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -138.83 167.32 22.26 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.668 1.187 . . . . 0.0 111.507 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -147.58 151.01 35.56 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 55.7 m -136.22 123.21 21.47 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.291 1.437 . . . . 0.0 109.81 -173.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -56.97 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -172.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.0 93.12 0.05 OUTLIER Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.322 0.963 . . . . 0.0 113.778 -178.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . 0.257 94.2 p 49.33 37.88 12.56 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.632 1.973 . . . . 0.0 115.997 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -122.73 157.63 31.91 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.93 1.692 . . . . 0.0 111.449 174.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -123.82 13.76 9.25 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.863 1.665 . . . . 0.0 112.801 177.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.429 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' PRO . . . . . 0.406 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p -132.56 165.95 23.21 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -140.55 147.56 39.66 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.618 1.167 . . . . 0.0 110.357 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.2 154.73 26.53 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.867 0.841 . . . . 0.0 112.073 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 33.1 mt -108.44 16.8 22.75 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.53 1.532 . . . . 0.0 111.847 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.41 148.96 17.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 167.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.255 1.39 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 177.442 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' C' ' 133' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.579 HD22 HD11 ' A' ' 30' ' ' LEU . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.502 HG23 HG23 ' A' ' 46' ' ' THR . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -63.37 -16.51 60.66 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -98.64 33.18 2.34 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.54 1.536 . . . . 0.0 111.182 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 40.2 mtt -128.34 121.51 29.33 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.357 1.463 . . . . 0.0 110.811 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.43 171.24 18.55 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.587 1.555 . . . . 0.0 111.738 -177.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -136.35 154.26 50.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.766 1.226 . . . . 0.0 112.62 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -66.42 168.3 9.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.359 1.464 . . . . 0.0 112.412 168.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.62 133.96 25.2 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.915 1.286 . . . . 0.0 109.796 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.497 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.497 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 168' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.38 166.44 25.47 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.89 70.1 2.21 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 125.192 3.928 . . . . 0.0 112.336 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.87 142.59 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 108.786 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -138.04 113.67 9.67 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.631 1.173 . . . . 0.0 109.961 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.85 129.86 42.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.952 0.901 . . . . 0.0 111.56 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -155.6 145.69 21.61 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.967 1.307 . . . . 0.0 110.073 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -102.94 142.25 34.36 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.2 1.0 . . . . 0.0 111.845 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 73.5 p -156.15 151.4 26.62 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.693 1.597 . . . . 0.0 111.277 173.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 89.8 mtt-85 36.07 58.78 3.17 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 127.215 2.206 . . . . 0.0 114.76 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 C--O 1.254 1.31 0 C-N-CA 124.072 3.182 . . . . 0.0 113.523 -176.284 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -111.63 7.41 20.46 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.707 1.203 . . . . 0.0 113.239 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -131.42 177.37 7.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.689 1.996 . . . . 0.0 110.728 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.04 168.48 2.43 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -109.83 -51.35 2.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.171 1.788 . . . . 0.0 113.771 -173.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -62.95 -13.98 41.54 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 176.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.545 HG13 ' H ' ' A' ' 8' ' ' GLY . 22.3 pt -118.62 -99.74 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.087 1.355 . . . . 0.0 109.37 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.545 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 68.45 23.43 75.15 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.223 0.916 . . . . 0.0 113.399 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -127.48 -43.85 1.57 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.919 1.688 . . . . 0.0 111.59 -175.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.35 156.39 4.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 125.062 1.345 . . . . 0.0 111.717 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.92 84.7 0.37 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 173.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -135.17 149.79 50.03 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.717 0.807 . . . . 0.0 112.372 172.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.508 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HB3' HD12 ' A' ' 36' ' ' ILE . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.466 HG23 HG23 ' C' ' 149' ' ' ILE . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.59 -28.52 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.35 -12.36 56.36 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.826 1.65 . . . . 0.0 114.76 173.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m120 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.765 2.026 . . . . 0.0 111.436 -177.59 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.468 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.1 t -61.43 137.5 58.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.873 1.269 . . . . 0.0 113.114 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -97.22 -28.4 14.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 77.0 mmm -131.41 156.98 44.64 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.833 1.653 . . . . 0.0 110.827 -175.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptp -116.95 -14.19 10.65 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -166.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -64.26 169.48 4.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.905 1.282 . . . . 0.0 111.456 164.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.28 134.55 57.1 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.643 0.777 . . . . 0.0 111.966 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm -134.61 167.93 19.92 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.551 1.14 . . . . 0.0 112.119 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -143.96 141.29 30.12 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 66.9 m -116.04 101.98 9.23 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.175 1.39 . . . . 0.0 110.188 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.81 66.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.254 1.421 . . . . 0.0 114.653 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.96 -129.45 43.89 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.512 -0.742 . . . . 0.0 112.466 -174.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.9 p -91.76 -3.27 56.38 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -176.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.06 160.15 21.64 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.376 1.07 . . . . 0.0 113.643 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -122.28 16.24 10.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.689 1.996 . . . . 0.0 112.449 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.51 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.472 ' HB2' HD12 ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p -135.68 167.19 21.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.12 142.42 36.04 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.509 1.124 . . . . 0.0 110.352 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.8 mt -60.02 147.66 38.27 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.312 1.045 . . . . 0.0 112.027 176.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 32.7 mt -102.78 18.4 21.56 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.217 1.407 . . . . 0.0 111.313 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.35 156.96 9.27 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 169.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.384 1.474 . . . . 0.0 113.654 178.564 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.466 HG23 HG23 ' A' ' 46' ' ' THR . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -21.0 7.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -95.89 2.91 53.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.108 1.363 . . . . 0.0 113.07 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 22.2 mtm -124.99 52.72 1.55 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.471 1.508 . . . . 0.0 111.737 -169.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -141.37 -175.87 4.51 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.372 1.869 . . . . 0.0 111.61 -173.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.37 157.87 45.77 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.468 1.107 . . . . 0.0 113.445 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -70.52 165.99 21.5 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.387 1.475 . . . . 0.0 112.622 171.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -127.93 135.5 27.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.491 1.516 . . . . 0.0 109.315 174.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.47 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.47 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 168' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.98 167.6 17.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.87 76.98 1.95 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 125.116 3.877 . . . . 0.0 110.958 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.79 154.38 26.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 125.491 1.516 . . . . 0.0 109.753 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -123.98 136.3 54.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.798 1.239 . . . . 0.0 109.346 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -132.87 138.26 46.96 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.776 1.23 . . . . 0.0 109.951 -174.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.93 149.74 49.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.344 0.658 . . . . 0.0 111.58 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -137.3 149.02 46.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.677 1.191 . . . . 0.0 112.062 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 26.1 t -156.38 151.53 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 110.952 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -65.67 153.1 91.52 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.388 1.075 . . . . 0.0 112.112 171.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.254 1.323 0 C-N-CA 124.16 3.24 . . . . 0.0 113.23 178.706 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.6 m -145.71 161.99 38.62 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.928 1.691 . . . . 0.0 111.541 -175.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -148.7 -176.38 5.3 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.434 1.494 . . . . 0.0 112.311 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -119.93 171.51 8.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.566 1.546 . . . . 0.0 113.16 -177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -116.9 -67.94 0.96 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.845 1.658 . . . . 0.0 112.064 -175.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -15.11 63.01 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.9 pt -141.28 -173.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.533 2.333 . . . . 0.0 109.477 -177.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 131.1 -24.16 4.27 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.748 1.166 . . . . 0.0 111.788 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -66.57 -34.97 79.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.572 1.949 . . . . 0.0 114.593 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.6 161.67 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 124.314 1.046 . . . . 0.0 111.623 -175.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -130.12 31.29 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.989 1.28 . . . . 0.0 114.339 -175.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -83.57 151.36 25.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.286 1.043 . . . . 0.0 112.698 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 20' ' ' LEU . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 27' ' ' LEU . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' HB2' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.435 HD21 HD22 ' C' ' 140' ' ' LEU . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.513 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.48 ' CE ' HD22 ' C' ' 133' ' ' LEU . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.513 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.532 HG23 HG23 ' C' ' 149' ' ' ILE . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m -72.14 -22.42 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -40.92 84.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.734 1.213 . . . . 0.0 113.029 175.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.071 1.748 . . . . 0.0 112.162 -179.317 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 CA-C-O 119.669 -0.517 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.0 m 51.72 37.28 19.78 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.016 1.726 . . . . 0.0 115.648 171.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -137.44 171.61 14.22 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.592 1.157 . . . . 0.0 113.775 -174.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 22.2 mmt -87.85 16.74 5.47 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.228 1.811 . . . . 0.0 114.314 -170.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt 47.17 32.97 2.24 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 130.198 3.399 . . . . 0.0 115.36 -169.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -137.86 167.13 22.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.522 1.929 . . . . 0.0 111.479 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -63.07 161.79 12.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.905 1.682 . . . . 0.0 112.891 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -128.63 162.97 26.08 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.342 1.057 . . . . 0.0 112.361 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 -143.85 150.36 38.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 89.8 m -133.62 109.81 9.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.593 1.557 . . . . 0.0 109.889 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.03 -26.48 67.65 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.24 41.46 94.75 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 121.171 -0.955 . . . . 0.0 113.61 -176.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 5.5 t 71.84 16.03 5.66 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.639 1.976 . . . . 0.0 115.282 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.98 164.41 20.05 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 112.785 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -113.52 4.65 16.29 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.977 1.711 . . . . 0.0 113.996 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.486 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.408 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.504 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p -131.83 170.9 14.2 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -151.49 161.74 42.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.045 0.938 . . . . 0.0 111.478 167.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.2 154.55 5.68 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.335 1.054 . . . . 0.0 113.015 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 12.4 mt -103.34 15.57 28.77 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.356 1.462 . . . . 0.0 112.102 174.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -67.99 -16.03 63.87 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 126.221 1.808 . . . . 0.0 115.135 176.003 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.48 HD22 ' CE ' ' A' ' 33' ' ' MET . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.435 HD22 HD21 ' A' ' 30' ' ' LEU . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.532 HG23 HG23 ' A' ' 46' ' ' THR . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -69.82 -4.0 18.19 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -138.14 30.45 2.45 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.467 1.507 . . . . 0.0 113.305 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.0 mtp -63.97 140.4 58.87 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.114 -0.991 . . . . 0.0 112.219 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.33 170.19 22.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.118 1.367 . . . . 0.0 111.631 174.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -157.89 -176.52 5.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.3 1.84 . . . . 0.0 111.331 -177.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.96 -50.37 2.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.893 1.277 . . . . 0.0 114.141 -176.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm 65.34 131.35 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.273 0 C-N-CA 127.723 2.409 . . . . 0.0 113.491 -174.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -68.47 169.84 16.27 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.17 77.73 1.56 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.574 3.516 . . . . 0.0 111.73 176.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.4 p -144.94 119.85 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.503 1.121 . . . . 0.0 111.243 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -147.17 -177.72 5.83 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.696 1.999 . . . . 0.0 110.448 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -73.63 80.6 1.51 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.602 1.561 . . . . 0.0 112.206 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 174.04 11.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.481 1.113 . . . . 0.0 113.48 175.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -105.32 152.75 22.53 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.547 1.139 . . . . 0.0 112.714 173.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 62.2 m -148.45 176.24 10.46 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.164 1.785 . . . . 0.0 111.355 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.55 64.16 9.02 Favored Pre-proline 0 N--CA 1.485 1.31 0 C-N-CA 125.948 1.699 . . . . 0.0 113.012 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--O 1.251 1.154 0 C-N-CA 124.137 3.225 . . . . 0.0 113.192 178.833 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.168 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.7 p -142.45 31.6 1.5 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.104 1.362 . . . . 0.0 113.542 -168.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -134.52 138.58 44.77 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.163 1.385 . . . . 0.0 111.246 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -145.63 -175.84 4.89 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.052 1.741 . . . . 0.0 111.657 -173.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -85.72 -76.94 0.31 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.696 0.798 . . . . 0.0 112.522 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -11.91 61.11 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.1 pt -140.53 -174.43 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.54 2.336 . . . . 0.0 109.42 -177.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 141.45 -32.15 2.09 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.606 1.098 . . . . 0.0 111.047 166.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.427 ' CE1' HG23 ' A' ' 60' ' ' VAL . 2.0 p80 -59.26 -39.96 84.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.805 2.042 . . . . 0.0 114.605 175.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -73.04 134.65 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.547 1.139 . . . . 0.0 110.42 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -110.53 27.03 11.87 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.354 1.454 . . . . 0.0 114.662 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -70.47 150.52 46.1 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.531 1.132 . . . . 0.0 112.334 -177.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.593 HD21 HD22 ' C' ' 140' ' ' LEU . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.405 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.4 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.629 HG23 HG23 ' C' ' 149' ' ' ILE . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.427 HG23 ' CE1' ' A' ' 9' ' ' HIS . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t -66.27 -23.24 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -22.07 61.42 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 171.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.799 2.44 . . . . 0.0 114.084 -178.561 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 111.599 -0.6 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -61.75 125.31 23.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.366 1.066 . . . . 0.0 112.492 -179.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -158.5 155.94 29.35 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.383 1.473 . . . . 0.0 110.938 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 23.3 ptp -65.48 173.46 2.67 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.836 0.854 . . . . 0.0 112.979 167.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -59.03 156.3 12.04 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 121.398 -0.814 . . . . 0.0 112.69 174.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -88.66 16.32 6.86 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.075 1.75 . . . . 0.0 114.856 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -122.22 130.43 53.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.242 1.417 . . . . 0.0 110.526 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' LYS . . . . . 0.453 ' HG2' HG23 ' B' ' 98' ' ' THR . 24.6 mtmt -143.48 167.67 21.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.645 1.178 . . . . 0.0 111.402 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -141.47 147.78 38.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 35.8 m -133.19 103.72 6.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.38 1.472 . . . . 0.0 109.991 -171.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.11 -27.47 68.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.198 1.399 . . . . 0.0 114.168 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.95 -72.85 1.55 Allowed Glycine 0 CA--C 1.533 1.215 0 C-N-CA 126.073 1.797 . . . . 0.0 114.129 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.1 m -144.93 0.64 0.96 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -80.34 165.96 21.78 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.487 1.115 . . . . 0.0 112.987 -178.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -121.32 9.17 10.33 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.374 1.869 . . . . 0.0 112.22 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 98' ' ' THR . . . . . 0.453 HG23 ' HG2' ' B' ' 73' ' ' LYS . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.552 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' B' ' 104' ' ' GLU . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p -135.29 -177.43 4.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.449 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 15.3 pttp -147.82 -96.38 0.08 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.888 0.875 . . . . 0.0 111.871 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 129' ' ' LEU . . . . . 0.449 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 50.0 mt -141.86 174.2 10.81 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.045 2.938 . . . . 0.0 109.199 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.1 mt -115.08 7.6 15.48 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.432 1.093 . . . . 0.0 112.558 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.12 157.2 29.26 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.978 0.911 . . . . 0.0 112.641 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 127.23 2.212 . . . . 0.0 114.553 -174.989 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 133' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' C' ' 133' ' ' LEU . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 30' ' ' LEU . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.629 HG23 HG23 ' A' ' 46' ' ' THR . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -65.22 -0.33 1.7 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -127.23 68.47 1.28 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.766 1.627 . . . . 0.0 110.344 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.2 mtt -136.44 174.67 10.37 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.37 1.868 . . . . 0.0 111.672 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . 63.75 178.89 0.16 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.772 2.029 . . . . 0.0 114.295 -171.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.78 166.54 30.16 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -169.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -81.54 175.95 10.08 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 112.546 175.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm -116.3 135.48 22.85 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.875 1.27 . . . . 0.0 109.862 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -68.94 161.46 45.62 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.67 78.66 1.65 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 124.639 3.56 . . . . 0.0 111.742 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 28.3 t -129.99 77.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.194 1.397 . . . . 0.0 109.234 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -154.78 172.9 17.22 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.408 1.483 . . . . 0.0 110.181 175.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -56.55 157.5 5.17 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.209 1.004 . . . . 0.0 112.881 173.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -55.68 130.12 41.91 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.395 1.478 . . . . 0.0 113.277 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -74.44 167.37 21.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.85 1.26 . . . . 0.0 112.953 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 66.2 m -137.01 163.47 30.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.845 1.658 . . . . 0.0 111.61 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -141.32 59.42 10.34 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.857 1.263 . . . . 0.0 112.421 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--O 1.251 1.164 0 C-N-CA 123.997 3.131 . . . . 0.0 113.343 -178.289 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.857 -0.497 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 p -90.09 179.53 5.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.89 8.38 44.81 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.991 1.316 . . . . 0.0 113.689 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.68 174.65 10.72 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.2 -62.26 1.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.848 1.659 . . . . 0.0 112.895 -175.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.51 -13.16 38.19 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 175.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.546 HG13 ' H ' ' A' ' 8' ' ' GLY . 20.2 pt -133.52 -66.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.749 1.22 . . . . 0.0 111.294 -178.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.546 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 73.88 6.67 73.57 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.586 1.089 . . . . 0.0 115.344 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -123.23 8.38 9.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.272 1.429 . . . . 0.0 113.388 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 t -136.84 124.59 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.505 1.122 . . . . 0.0 109.738 -171.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.95 35.35 5.09 Favored Glycine 0 N--CA 1.473 1.128 0 C-N-CA 124.874 1.226 . . . . 0.0 113.634 -170.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -80.67 149.9 29.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.779 0.831 . . . . 0.0 112.428 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 20' ' ' LEU . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.619 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.514 ' CD2' HD21 ' A' ' 41' ' ' LEU . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.514 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.474 HG23 HG23 ' C' ' 149' ' ' ILE . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t -72.55 -26.71 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -30.56 71.6 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 170.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 C--O 1.254 1.324 0 C-N-CA 124.991 1.317 . . . . 0.0 113.499 -173.786 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 112.443 -0.263 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 47.21 48.65 15.9 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.452 1.901 . . . . 0.0 114.008 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -57.0 -22.67 40.25 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.914 2.086 . . . . 0.0 115.245 -175.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 30.1 mtm -140.78 138.18 33.91 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.84 1.656 . . . . 0.0 110.357 172.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -134.88 5.99 3.38 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.525 1.53 . . . . 0.0 113.955 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -38.22 84.8 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.98 0.809 . . . . 0.0 112.088 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -158.65 132.4 7.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.174 0.99 . . . . 0.0 111.451 166.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt -139.0 166.42 24.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.892 1.677 . . . . 0.0 111.253 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -145.74 148.47 33.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 36.3 m -125.65 95.92 4.61 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.369 1.468 . . . . 0.0 110.466 -171.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.52 -30.39 71.43 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.169 1.388 . . . . 0.0 114.69 -177.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.89 -144.37 48.97 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 121.344 -0.847 . . . . 0.0 112.96 -171.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 73.6 p -69.37 -12.47 61.68 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -66.39 120.41 13.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.32 1.048 . . . . 0.0 112.584 -178.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 4.52 20.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.432 1.493 . . . . 0.0 114.635 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 104' ' ' GLU . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' HIS . . . . . 0.451 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 122' ' ' PHE . . . . . 0.423 ' CE1' HG21 ' B' ' 127' ' ' THR . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 123' ' ' PRO . . . . . 0.405 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.466 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.423 HG21 ' CE1' ' B' ' 122' ' ' PHE . 18.9 p -133.95 170.68 15.26 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -152.66 155.82 38.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.312 1.445 . . . . 0.0 111.002 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.4 mp -59.72 159.41 8.77 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.819 0.818 . . . . 0.0 112.408 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -107.56 16.48 23.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.376 1.47 . . . . 0.0 112.204 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -56.64 145.47 28.52 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.619 0.768 . . . . 0.0 112.87 166.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.488 1.435 0 C-N-CA 127.328 2.251 . . . . 0.0 115.001 -173.315 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 140' ' ' LEU . . . . . 0.619 HD22 HD11 ' A' ' 30' ' ' LEU . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 149' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 46' ' ' THR . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -70.84 1.04 5.98 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -116.54 16.25 15.55 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.582 1.553 . . . . 0.0 113.79 175.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 20.1 mtt -70.76 -173.75 0.81 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.973 0.909 . . . . 0.0 112.249 167.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -51.69 126.73 18.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.968 1.307 . . . . 0.0 113.758 -178.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -143.36 -55.78 0.4 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.889 1.276 . . . . 0.0 112.109 -173.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.77 175.81 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.006 2.122 . . . . 0.0 110.44 -172.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm -112.29 134.84 21.43 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.444 1.097 . . . . 0.0 109.647 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 168' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.84 168.83 19.17 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.11 75.59 2.27 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 124.848 3.699 . . . . 0.0 111.438 174.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.3 p -143.2 145.56 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.903 1.281 . . . . 0.0 110.921 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 50.86 26.2 2.52 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.671 1.588 . . . . 0.0 114.253 -174.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 49.9 p30 -148.87 179.42 7.87 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.255 1.822 . . . . 0.0 112.074 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -144.95 141.55 29.09 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.139 1.376 . . . . 0.0 110.208 175.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -141.68 174.06 10.92 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.201 1.401 . . . . 0.0 112.096 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 2.9 t -121.75 30.26 6.76 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.814 1.646 . . . . 0.0 111.836 -178.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 50.1 mmm-85 -132.77 57.05 25.63 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 126.906 2.083 . . . . 0.0 111.611 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.007 3.138 . . . . 0.0 113.36 -179.167 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 120.615 0.245 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.465 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.585 HD21 HD22 ' C' ' 140' ' ' LEU . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.525 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.4 HD11 HD21 ' C' ' 140' ' ' LEU . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.525 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.457 HG23 HG23 ' C' ' 149' ' ' ILE . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.412 0.625 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 . . . . . 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.474 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.474 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.41 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.585 HD22 HD21 ' A' ' 30' ' ' LEU . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.457 HG23 HG23 ' A' ' 46' ' ' THR . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.498 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.498 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.489 HD21 HD22 ' C' ' 140' ' ' LEU . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB3' HD12 ' A' ' 36' ' ' ILE . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.486 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.493 HG23 HG23 ' C' ' 149' ' ' ILE . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.15 0.5 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.419 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.488 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.496 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 30' ' ' LEU . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.493 HG23 HG23 ' A' ' 46' ' ' THR . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.511 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.511 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.517 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' A' ' 36' ' ' ILE . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.426 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.517 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.498 HG23 HG23 ' C' ' 149' ' ' ILE . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.427 ' CD2' HD13 ' C' ' 140' ' ' LEU . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 120.84 0.352 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.501 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.501 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.489 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' C' ' 133' ' ' LEU . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 53' ' ' PHE . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 46' ' ' THR . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 . . . . . 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.491 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.491 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.422 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.406 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.504 HG23 HG23 ' C' ' 149' ' ' ILE . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 121.358 0.599 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.413 HG22 HG13 ' C' ' 159' ' ' ILE . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.608 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.608 HD21 ' HB3' ' B' ' 104' ' ' GLU . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 36' ' ' ILE . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.504 HG23 HG23 ' A' ' 46' ' ' THR . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . 0.413 HG13 HG22 ' B' ' 101' ' ' ILE . 9.7 mm . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.447 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.675 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.485 HG23 HG23 ' C' ' 149' ' ' ILE . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 121.101 0.477 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.412 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.476 ' HB2' HD12 ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.675 HD22 HD11 ' A' ' 30' ' ' LEU . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.485 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm . . . . . 0 CA--C 1.55 0.961 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 . . . . . 0 CA--C 1.535 0.398 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.517 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.523 ' HB3' HD21 ' C' ' 133' ' ' LEU . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.628 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 36' ' ' ILE . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.407 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.506 HG23 HG23 ' C' ' 149' ' ' ILE . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.034 0.445 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.457 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 29' ' ' ASN . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 30' ' ' LEU . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 46' ' ' THR . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.488 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.488 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.488 HD21 HD23 ' A' ' 41' ' ' LEU . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.417 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 25' ' ' PRO . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.406 HD21 HD22 ' C' ' 140' ' ' LEU . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.452 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.488 HD23 HD21 ' A' ' 20' ' ' LEU . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.499 HG23 HG23 ' C' ' 149' ' ' ILE . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.902 0.382 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.483 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.483 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.465 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.406 HD22 HD21 ' A' ' 30' ' ' LEU . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.499 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm . . . . . 0 CA--C 1.558 1.282 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 120.555 0.217 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.547 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.697 HD11 HD22 ' C' ' 140' ' ' LEU . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.428 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.676 HG23 HG23 ' C' ' 149' ' ' ILE . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . 0.502 ' HG2' HG23 ' B' ' 98' ' ' THR . 33.4 mtmt . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.059 0.457 . . . . 0.0 111.493 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . 0.502 HG23 ' HG2' ' B' ' 73' ' ' LYS . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.459 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.459 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.442 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.442 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 30' ' ' LEU . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.676 HG23 HG23 ' A' ' 46' ' ' THR . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 . . . . . 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.513 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 27' ' ' LEU . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.464 HD21 HD22 ' C' ' 140' ' ' LEU . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HB3' HD12 ' A' ' 36' ' ' ILE . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD21 ' CD2' ' A' ' 31' ' ' PHE . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.425 ' HB3' ' HB ' ' A' ' 46' ' ' THR . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.497 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.622 HG23 HG23 ' C' ' 149' ' ' ILE . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt . . . . . 0 N--CA 1.471 0.625 0 CA-C-O 121.185 0.517 . . . . 0.0 112.084 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 . . . . . 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.49 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.49 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.44 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.464 HD22 HD21 ' A' ' 30' ' ' LEU . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.622 HG23 HG23 ' A' ' 46' ' ' THR . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo . . . . . 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' C' ' 133' ' ' LEU . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.701 HD21 HD22 ' C' ' 140' ' ' LEU . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.494 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.477 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.523 HG23 HG23 ' C' ' 149' ' ' ILE . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.551 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t . . . . . 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 121.222 0.534 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 . . . . . 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.437 HG22 HG13 ' C' ' 159' ' ' ILE . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.467 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.414 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.44 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.701 HD22 HD21 ' A' ' 30' ' ' LEU . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.523 HG23 HG23 ' A' ' 46' ' ' THR . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . 0.437 HG13 HG22 ' B' ' 101' ' ' ILE . 13.4 mm . . . . . 0 CA--C 1.557 1.249 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.515 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 23' ' ' LEU . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.491 HD21 HD22 ' C' ' 140' ' ' LEU . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.531 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.496 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.531 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.496 HG23 HG23 ' C' ' 149' ' ' ILE . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.985 0.422 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.509 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.496 HD21 HD11 ' A' ' 36' ' ' ILE . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.496 HG23 HG23 ' A' ' 46' ' ' THR . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm . . . . . 0 CA--C 1.56 1.343 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.508 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.508 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD21 HD23 ' A' ' 41' ' ' LEU . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.77 HD11 HD22 ' C' ' 140' ' ' LEU . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.49 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.476 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.601 HG23 HG23 ' C' ' 149' ' ' ILE . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' C' ' 140' ' ' LEU . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' B' ' 98' ' ' THR . 23.2 mtmm . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.695 0.284 . . . . 0.0 111.311 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . 0.435 HG23 ' HG2' ' B' ' 73' ' ' LYS . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.481 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.481 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.432 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.446 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.77 HD22 HD11 ' A' ' 30' ' ' LEU . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.601 HG23 HG23 ' A' ' 46' ' ' THR . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 . . . . . 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.553 1.078 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.504 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 81.8 t90 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.569 0.223 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 20' ' ' LEU . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.75 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.455 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.487 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.589 HG23 HG23 ' C' ' 149' ' ' ILE . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.922 0.391 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.47 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.47 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.446 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.75 HD22 HD11 ' A' ' 30' ' ' LEU . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.589 HG23 HG23 ' A' ' 46' ' ' THR . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm . . . . . 0 CA--C 1.553 1.081 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.0 t90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HD22 ' C' ' 140' ' ' LEU . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.464 HD11 HD21 ' C' ' 140' ' ' LEU . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.484 HG23 HG23 ' C' ' 149' ' ' ILE . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.708 0.29 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.402 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.471 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.471 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.464 HD21 HD11 ' A' ' 36' ' ' ILE . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.484 HG23 HG23 ' A' ' 46' ' ' THR . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 . . . . . 0 CA--C 1.539 0.524 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CD1' HD22 ' A' ' 41' ' ' LEU . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.445 HD21 HD22 ' C' ' 140' ' ' LEU . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.506 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 18' ' ' PHE . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.424 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.46 HG23 HG23 ' C' ' 149' ' ' ILE . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' C' ' 140' ' ' LEU . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t . . . . . 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.632 0.73 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 . . . . . 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.476 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.476 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.405 ' CE1' HG22 ' B' ' 115' ' ' VAL . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.405 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' HD23 ' B' ' 109' ' ' LEU . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 36' ' ' ILE . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.46 HG23 HG23 ' A' ' 46' ' ' THR . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 . . . . . 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.552 1.025 0 CA-C-O 119.509 -0.281 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 HD22 ' C' ' 140' ' ' LEU . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.401 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.502 HG23 HG23 ' C' ' 149' ' ' ILE . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.108 0.48 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.429 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . 0.406 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' C' ' 133' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.579 HD22 HD11 ' A' ' 30' ' ' LEU . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.502 HG23 HG23 ' A' ' 46' ' ' THR . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.497 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.497 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.508 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HB3' HD12 ' A' ' 36' ' ' ILE . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.466 HG23 HG23 ' C' ' 149' ' ' ILE . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 121.412 0.625 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 . . . . . 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 121.361 0.6 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.51 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.472 ' HB2' HD12 ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.466 HG23 HG23 ' A' ' 46' ' ' THR . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.47 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.47 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.447 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 27' ' ' LEU . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.437 ' HB2' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.435 HD21 HD22 ' C' ' 140' ' ' LEU . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.513 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.48 ' CE ' HD22 ' C' ' 133' ' ' LEU . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.513 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.532 HG23 HG23 ' C' ' 149' ' ' ILE . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.456 0.646 . . . . 0.0 112.361 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.486 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.408 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.504 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.48 HD22 ' CE ' ' A' ' 33' ' ' MET . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.435 HD22 HD21 ' A' ' 30' ' ' LEU . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.532 HG23 HG23 ' A' ' 46' ' ' THR . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.558 1.273 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo . . . . . 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.593 HD21 HD22 ' C' ' 140' ' ' LEU . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.405 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.4 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.629 HG23 HG23 ' C' ' 149' ' ' ILE . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t . . . . . 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . 0.453 ' HG2' HG23 ' B' ' 98' ' ' THR . 24.6 mtmt . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . 0.453 HG23 ' HG2' ' B' ' 73' ' ' LYS . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.552 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' B' ' 104' ' ' GLU . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' C' ' 133' ' ' LEU . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 30' ' ' LEU . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.629 HG23 HG23 ' A' ' 46' ' ' THR . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm . . . . . 0 CA--C 1.55 0.969 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo . . . . . 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.619 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.514 ' CD2' HD21 ' A' ' 41' ' ' LEU . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.514 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.474 HG23 HG23 ' C' ' 149' ' ' ILE . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.896 0.379 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 104' ' ' GLU . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' HIS . . . . . 0.451 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . 0.423 ' CE1' HG21 ' B' ' 127' ' ' THR . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' PRO . . . . . 0.405 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' SER . . . . . 0.466 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.423 HG21 ' CE1' ' B' ' 122' ' ' PHE . 18.9 p . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 140' ' ' LEU . . . . . 0.619 HD22 HD11 ' A' ' 30' ' ' LEU . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 149' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 46' ' ' THR . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? . . . . . 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 168' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -144.37 160.62 40.74 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.791 1.236 . . . . 0.0 112.519 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -145.11 165.98 26.71 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.81 1.644 . . . . 0.0 111.741 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -66.59 171.32 5.19 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.476 1.288 . . . . 0.0 114.476 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.26 -67.58 0.98 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.676 1.59 . . . . 0.0 112.657 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.4 -14.8 63.26 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.7 pt -142.49 -171.8 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 128.058 2.543 . . . . 0.0 109.101 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.66 -29.24 4.51 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.579 1.085 . . . . 0.0 111.624 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -57.34 -43.99 83.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.81 1.644 . . . . 0.0 113.342 170.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.56 129.33 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.614 0.766 . . . . 0.0 110.386 177.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.86 97.06 1.46 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 107.236 -2.346 . . . . 0.0 107.236 169.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -139.58 147.89 41.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.291 1.836 . . . . 0.0 110.908 170.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -136.62 143.28 42.37 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.457 1.103 . . . . 0.0 113.925 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.64 2.96 3.51 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 125.031 3.821 . . . . 0.0 115.207 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -108.03 -33.85 7.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.855 1.262 . . . . 0.0 113.011 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 82.5 p -130.5 -28.35 2.08 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.54 1.136 . . . . 0.0 113.366 -168.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.61 -161.18 14.1 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.744 1.164 . . . . 0.0 114.471 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -63.44 146.3 53.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.208 1.003 . . . . 0.0 111.144 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.58 76.09 5.05 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.114 1.365 . . . . 0.0 112.231 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.465 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.3 mm? -47.13 -42.36 19.2 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.115 1.366 . . . . 0.0 114.097 -175.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.62 -21.4 39.21 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.694 1.598 . . . . 0.0 114.503 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -139.85 21.18 2.49 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.645 1.578 . . . . 0.0 112.889 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.67 150.88 35.19 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-O 121.997 0.903 . . . . 0.0 112.967 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.02 159.0 68.17 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.574 1.55 . . . . 0.0 113.412 -178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.08 -11.09 30.9 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.985 3.123 . . . . 0.0 114.234 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -107.17 -28.65 9.83 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.868 1.267 . . . . 0.0 112.429 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.39 -66.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.158 0.983 . . . . 0.0 111.165 -163.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.08 -29.48 57.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.224 -0.898 . . . . 0.0 113.052 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -73.56 -41.1 63.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.342 1.057 . . . . 0.0 110.685 -172.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.585 HD21 HD22 ' C' ' 140' ' ' LEU . 22.6 tp -64.11 -46.12 85.58 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.643 1.177 . . . . 0.0 111.864 164.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.525 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -56.93 -43.59 81.62 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.955 0.798 . . . . 0.0 111.037 -176.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -68.64 -19.75 64.43 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.708 1.203 . . . . 0.0 113.434 174.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 3.2 ttp -86.95 -55.97 3.59 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.02 1.328 . . . . 0.0 112.522 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.1 t -68.5 -24.97 64.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.456 1.025 . . . . 0.0 111.901 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.13 5.04 11.92 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.964 1.269 . . . . 0.0 114.688 171.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.4 HD11 HD21 ' C' ' 140' ' ' LEU . 2.9 mt -61.42 146.6 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.816 1.646 . . . . 0.0 110.978 177.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.3 t -118.39 159.6 23.15 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.937 0.895 . . . . 0.0 112.084 176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.4 mp0 -54.84 -26.42 35.06 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.743 1.617 . . . . 0.0 113.834 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.96 -43.9 94.75 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.432 -0.792 . . . . 0.0 113.137 170.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -71.77 -35.66 70.11 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.522 0.729 . . . . 0.0 111.081 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.525 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -62.86 -27.59 69.44 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.886 1.675 . . . . 0.0 112.845 173.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -96.3 1.81 52.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.05 1.34 . . . . 0.0 113.259 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -89.58 112.88 24.22 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.724 1.21 . . . . 0.0 109.57 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.8 -13.7 16.95 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -103.33 -19.25 14.52 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.445 1.498 . . . . 0.0 112.993 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.457 HG23 HG23 ' C' ' 149' ' ' ILE . 22.7 m -107.17 -51.95 2.84 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.122 0.969 . . . . 0.0 111.394 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.7 p -52.52 -37.87 58.47 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.772 1.229 . . . . 0.0 113.251 174.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -52.72 -50.23 63.81 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.5 1.12 . . . . 0.0 112.657 171.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.21 -45.06 91.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.626 0.77 . . . . 0.0 110.56 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.5 mt -61.7 -39.22 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 O-C-N 122.098 -0.376 . . . . 0.0 110.273 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.86 -44.2 77.65 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.663 1.185 . . . . 0.0 113.22 175.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -56.95 -29.95 63.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.738 0.815 . . . . 0.0 112.92 177.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -65.25 -51.47 60.65 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.481 0.712 . . . . 0.0 111.876 170.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt -61.82 -38.08 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 O-C-N 121.049 -1.032 . . . . 0.0 111.159 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.08 -11.99 45.72 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -126.19 -17.75 5.16 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 87.4 m -147.35 -23.42 0.39 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.188 1.395 . . . . 0.0 113.157 -166.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -110.31 0.2 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 164.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.8 125.23 0.04 OUTLIER Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.502 2.001 . . . . 0.0 113.762 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.1 p -59.91 -30.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -176.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -86.45 -32.32 20.91 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.493 1.117 . . . . 0.0 112.905 175.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.85 -40.52 83.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.552 1.541 . . . . 0.0 112.77 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.3 t -71.46 -30.09 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.456 1.102 . . . . 0.0 111.624 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -33.43 75.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.046 1.338 . . . . 0.0 113.521 173.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 125.515 1.526 . . . . 0.0 113.024 177.913 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.556 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.5 t -147.69 161.0 42.08 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.265 1.826 . . . . 0.0 111.606 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -151.38 -167.13 2.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.619 1.568 . . . . 0.0 111.926 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 66.8 mtp -41.53 128.71 3.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.554 1.942 . . . . 0.0 113.596 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -71.75 152.91 42.36 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.474 1.11 . . . . 0.0 111.644 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -69.89 -45.67 67.13 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.117 0.967 . . . . 0.0 112.093 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -68.74 126.04 28.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.227 1.011 . . . . 0.0 111.999 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -137.22 166.7 23.13 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.474 1.11 . . . . 0.0 111.515 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.71 151.67 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.763 1.625 . . . . 0.0 110.201 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -96.99 125.74 41.63 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 163.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.1 p -67.46 137.06 55.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 166.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.77 -1.69 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.928 -1.107 . . . . 0.0 111.806 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -153.78 157.27 32.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.741 2.017 . . . . 0.0 111.214 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -73.27 164.46 35.21 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.711 2.941 . . . . 0.0 113.653 177.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -148.34 156.65 42.77 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.671 1.588 . . . . 0.0 111.439 173.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 48.3 m -139.01 118.97 13.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.458 1.503 . . . . 0.0 111.292 -170.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.09 -51.41 25.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.33 -158.31 31.35 Favored Glycine 0 CA--C 1.543 1.787 0 O-C-N 121.286 -0.884 . . . . 0.0 113.297 -162.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.2 m -74.13 82.93 1.8 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.765 1.226 . . . . 0.0 112.968 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.93 -23.19 0.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 172.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 58.55 9.74 1.19 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 126.853 2.061 . . . . 0.0 115.922 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 33.4 p -132.67 4.31 3.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.577 1.951 . . . . 0.0 113.167 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 37.1 mt -107.56 156.34 19.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.865 1.266 . . . . 0.0 112.21 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -114.96 126.64 55.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.362 1.465 . . . . 0.0 110.001 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 18.0 m -110.55 145.32 38.0 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.607 1.163 . . . . 0.0 111.367 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -162.37 177.73 9.3 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.664 1.586 . . . . 0.0 112.07 -174.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.78 -177.55 3.37 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.468 1.507 . . . . 0.0 111.242 170.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.1 tm0? -68.9 145.09 53.98 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.107 -0.995 . . . . 0.0 111.239 167.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.9 -1.62 88.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.066 0.841 . . . . 0.0 113.936 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -75.47 165.95 24.33 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.254 1.422 . . . . 0.0 112.904 172.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 80.9 t -130.89 133.29 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.111 1.365 . . . . 0.0 110.6 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -129.81 139.6 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.425 1.49 . . . . 0.0 109.351 -175.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.6 m -104.39 123.62 47.76 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.54 1.136 . . . . 0.0 110.163 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.65 132.93 46.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.744 0.818 . . . . 0.0 111.249 -177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 89.8 mt -107.96 -3.03 19.21 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.055 1.342 . . . . 0.0 113.208 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -125.51 153.57 72.58 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.727 1.611 . . . . 0.0 110.621 -172.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.42 -26.29 12.3 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.31 2.673 . . . . 0.0 114.602 -175.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -155.87 162.55 40.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.362 1.465 . . . . 0.0 112.036 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.55 167.98 19.54 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 176.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.41 122.66 13.0 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.302 173.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.4 t0 51.88 24.09 2.39 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.253 -1.529 . . . . 0.0 114.911 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.03 -5.59 78.92 Favored Glycine 0 CA--C 1.541 1.7 0 C-N-CA 125.561 1.553 . . . . 0.0 115.943 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.474 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -86.86 133.56 33.61 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.405 1.882 . . . . 0.0 111.917 172.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.474 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.08 152.48 38.62 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.854 2.062 . . . . 0.0 109.309 176.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -122.69 135.41 54.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.762 0.792 . . . . 0.0 110.561 -175.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.74 -176.62 35.84 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.741 -171.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -129.85 128.03 41.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.839 1.656 . . . . 0.0 109.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -69.75 132.72 46.54 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.65 1.18 . . . . 0.0 112.539 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.86 8.33 2.54 Favored 'General case' 0 CA--C 1.558 1.279 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -176.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.96 -21.04 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.716 -1.24 . . . . 0.0 113.958 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.2 t -137.24 -14.51 1.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.121 1.368 . . . . 0.0 112.721 -172.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.73 16.74 9.97 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.837 2.055 . . . . 0.0 113.549 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.44 58.62 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.321 1.448 . . . . 0.0 111.086 170.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -123.14 155.18 37.52 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.713 1.605 . . . . 0.0 111.128 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.2 168.2 23.75 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 123.868 0.747 . . . . 0.0 112.227 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -71.84 132.81 44.94 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 170.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.82 154.22 78.06 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.983 1.313 . . . . 0.0 111.876 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.33 118.41 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.569 2.846 . . . . 0.0 112.481 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.41 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.4 OUTLIER -56.82 -37.42 71.17 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 173.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -29.81 70.45 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -174.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -79.62 8.24 6.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.657 1.183 . . . . 0.0 113.325 171.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -137.71 163.99 29.95 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.517 -1.364 . . . . 0.0 112.477 -177.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -141.66 153.0 44.42 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.723 1.209 . . . . 0.0 110.723 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.83 160.28 12.3 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.178 0.99 . . . . 0.0 113.17 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 62.7 mt -115.94 23.41 12.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.119 1.768 . . . . 0.0 111.742 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -58.2 166.29 1.67 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.931 0.892 . . . . 0.0 113.235 162.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.773 2.029 . . . . 0.0 114.269 -175.26 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.396 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.58 -34.66 19.04 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.887 1.71 . . . . 0.0 113.651 -164.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -71.9 -29.53 64.42 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.4 t -64.64 -38.07 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.082 0.953 . . . . 0.0 110.938 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.7 -32.63 74.38 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.585 -1.322 . . . . 0.0 113.453 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.72 -19.68 62.72 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.325 0.966 . . . . 0.0 112.772 -176.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -102.54 -24.22 13.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.085 2.154 . . . . 0.0 113.231 176.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.585 HD22 HD21 ' A' ' 30' ' ' LEU . 66.4 tp -61.48 -49.05 78.35 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.285 0.948 . . . . 0.0 111.871 171.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 43.6 mtt -56.94 -36.12 69.87 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -65.13 -36.68 85.04 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.334 1.454 . . . . 0.0 112.804 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -69.72 -48.04 60.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.736 0.698 . . . . 0.0 112.57 174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.3 mt -62.73 -30.09 71.16 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.761 -0.587 . . . . 0.0 112.255 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.45 -22.29 66.21 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.295 1.438 . . . . 0.0 113.111 178.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -79.29 -19.91 49.33 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.64 1.576 . . . . 0.0 112.546 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -116.72 -0.97 12.2 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.351 1.86 . . . . 0.0 112.411 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.74 63.99 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.934 1.254 . . . . 0.0 114.962 -171.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.457 HG23 HG23 ' A' ' 46' ' ' THR . 28.7 mm -65.34 150.14 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-N 119.153 1.476 . . . . 0.0 109.048 167.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -140.96 150.65 60.05 Favored Pre-proline 0 N--CA 1.469 0.499 0 C-N-CA 125.072 1.349 . . . . 0.0 109.144 171.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -63.43 156.98 53.11 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.467 2.111 . . . . 0.0 111.369 172.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -16.4 64.24 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.677 1.191 . . . . 0.0 113.8 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ptm85 -61.63 -14.42 30.62 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 165.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -134.08 45.99 2.56 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.228 1.411 . . . . 0.0 113.142 -166.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 ptp -130.71 146.44 52.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.859 1.264 . . . . 0.0 112.076 176.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.19 168.57 26.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.373 1.869 . . . . 0.0 111.38 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.26 -179.03 2.7 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 172.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -126.18 174.91 8.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.106 2.563 . . . . 0.0 110.698 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.5 mm -117.0 133.42 23.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 123.934 0.894 . . . . 0.0 110.582 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.63 174.21 7.83 Favored 'Trans proline' 0 CA--C 1.55 1.281 1 C-N-CA 126.095 4.53 . . . . 0.0 114.123 176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.55 -77.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.582 2.854 . . . . 0.0 113.872 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.498 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.92 163.02 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 129.375 3.07 . . . . 0.0 112.713 -173.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.498 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 85.7 Cg_endo -72.31 172.8 14.18 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.312 3.341 . . . . 0.0 114.045 174.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -86.63 1.88 50.33 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.209 1.404 . . . . 0.0 114.491 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 26.4 p90 -135.78 158.87 73.21 Favored Pre-proline 0 N--CA 1.473 0.717 0 C-N-CA 125.597 1.559 . . . . 0.0 111.488 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.78 157.3 58.79 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.575 2.183 . . . . 0.0 113.808 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.38 133.26 95.42 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.324 0.65 . . . . 0.0 112.021 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.9 168.46 17.03 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.94 3.093 . . . . 0.0 113.488 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 29.3 p -131.69 149.38 73.29 Favored Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 125.459 1.504 . . . . 0.0 112.492 -173.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -69.26 167.39 23.91 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 124.778 3.652 . . . . 0.0 113.316 -174.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -68.76 75.21 0.85 Allowed 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 124.786 3.658 . . . . 0.0 112.707 174.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.2 t -136.88 117.09 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 125.786 1.635 . . . . 0.0 108.257 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -151.76 168.93 23.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.418 1.087 . . . . 0.0 112.984 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -73.79 176.59 6.18 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.648 1.179 . . . . 0.0 112.055 168.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -131.85 125.14 31.05 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.509 1.524 . . . . 0.0 109.28 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.7 139.65 49.81 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 112.709 -172.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 70.2 m -136.4 145.43 45.31 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.488 1.115 . . . . 0.0 111.987 -175.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -61.92 156.22 58.3 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.318 1.447 . . . . 0.0 112.944 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--O 1.255 1.326 0 C-N-CA 123.796 2.997 . . . . 0.0 113.5 177.894 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -74.29 164.24 26.85 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.132 0.973 . . . . 0.0 112.7 174.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -137.47 176.11 9.0 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.057 1.743 . . . . 0.0 111.736 -178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -130.76 171.29 13.29 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.781 1.632 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -113.89 -69.31 0.87 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.748 1.619 . . . . 0.0 112.152 -175.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -70.55 -14.41 62.49 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 pt -141.61 -167.91 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.907 2.483 . . . . 0.0 109.074 -177.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.12 -10.46 40.04 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 123.809 0.719 . . . . 0.0 113.127 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -81.07 -34.24 32.84 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.524 1.93 . . . . 0.0 113.725 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.35 -29.71 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.741 1.617 . . . . 0.0 115.141 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 71.27 22.44 78.54 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.86 1.219 . . . . 0.0 115.727 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -80.49 147.05 31.05 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.895 1.348 . . . . 0.0 111.698 175.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -137.6 144.85 46.5 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.45 3.09 3.32 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 125.344 4.029 . . . . 0.0 115.724 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -115.89 -25.88 7.56 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.132 1.373 . . . . 0.0 113.636 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.2 p -131.79 -27.31 1.9 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.222 1.009 . . . . 0.0 112.929 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.64 -160.6 18.05 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.794 1.188 . . . . 0.0 113.829 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -60.55 147.82 40.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.5 1.12 . . . . 0.0 111.936 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -91.11 78.0 5.94 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.0 mm? -49.57 -41.18 40.98 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.84 -1.162 . . . . 0.0 113.86 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -60.02 -21.2 61.03 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.229 1.411 . . . . 0.0 114.417 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -140.31 23.02 2.37 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.782 1.633 . . . . 0.0 112.513 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.4 mt -60.95 150.42 33.39 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.946 0.879 . . . . 0.0 111.974 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.97 158.27 55.21 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.653 1.181 . . . . 0.0 113.085 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.07 -14.0 42.83 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 124.034 3.156 . . . . 0.0 113.86 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -110.89 -19.38 12.83 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.445 1.098 . . . . 0.0 112.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.6 -65.71 0.83 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.363 1.065 . . . . 0.0 111.77 -167.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -30.64 59.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.172 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.76 -45.42 86.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.941 1.296 . . . . 0.0 110.619 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.489 HD21 HD22 ' C' ' 140' ' ' LEU . 13.1 tp -66.74 -44.54 81.23 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.263 1.025 . . . . 0.0 111.624 172.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.2 m-85 -56.55 -44.84 81.29 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.436 0.562 . . . . 0.0 110.657 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.11 -18.13 62.54 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 12.3 tpp -80.11 -57.7 3.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.567 1.147 . . . . 0.0 111.398 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB3' HD12 ' A' ' 36' ' ' ILE . 22.3 t -68.44 -29.42 68.07 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.14 3.57 11.78 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 124.761 1.172 . . . . 0.0 114.813 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -61.85 147.22 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 118.417 1.109 . . . . 0.0 110.805 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -125.04 165.74 17.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.649 0.78 . . . . 0.0 112.921 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -50.47 -31.14 14.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.341 1.456 . . . . 0.0 114.641 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.86 99.75 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.5 -37.87 83.46 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 122.951 0.5 . . . . 0.0 110.673 176.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.9 mp -65.2 -25.67 67.81 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 125.962 1.705 . . . . 0.0 113.425 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.82 1.85 46.23 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.907 1.283 . . . . 0.0 112.878 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -87.07 112.55 22.0 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.827 1.251 . . . . 0.0 109.296 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.486 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.0 OUTLIER -60.52 -15.88 31.68 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 120.939 -1.101 . . . . 0.0 113.803 -179.394 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -96.96 -33.39 11.59 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.753 1.221 . . . . 0.0 112.4 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.493 HG23 HG23 ' C' ' 149' ' ' ILE . 19.0 m -91.29 -51.37 5.33 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.053 0.842 . . . . 0.0 111.69 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -54.64 -36.97 65.1 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.696 1.198 . . . . 0.0 112.8 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -53.7 -49.68 67.54 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.399 1.08 . . . . 0.0 112.613 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.74 -45.76 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.136 0.574 . . . . 0.0 110.781 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.6 mt -60.59 -40.19 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 O-C-N 122.092 -0.38 . . . . 0.0 110.276 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -68.33 -42.39 79.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.457 1.103 . . . . 0.0 113.315 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.93 -31.29 64.8 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.543 -0.723 . . . . 0.0 112.266 176.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.86 -50.96 64.56 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.266 0.626 . . . . 0.0 111.767 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -61.49 -39.09 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 120.84 -1.162 . . . . 0.0 111.469 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -66.21 -14.92 62.69 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.856 0.862 . . . . 0.0 113.159 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -124.1 -13.91 7.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -174.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.2 m -148.13 -25.33 0.35 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.24 1.416 . . . . 0.0 113.142 -169.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.15 -109.44 0.19 Allowed Glycine 0 CA--C 1.526 0.741 0 CA-C-O 118.393 -1.226 . . . . 0.0 110.068 166.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.77 123.84 0.03 OUTLIER Glycine 0 CA--C 1.537 1.441 0 C-N-CA 126.526 2.012 . . . . 0.0 113.819 -173.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.75 -31.2 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.203 -1.175 . . . . 0.0 113.937 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -86.37 -32.31 21.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.298 1.039 . . . . 0.0 113.425 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.37 -41.68 84.68 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.401 1.48 . . . . 0.0 113.105 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.1 t -69.47 -29.85 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.615 0.766 . . . . 0.0 111.63 177.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.94 -31.14 71.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.052 1.341 . . . . 0.0 113.795 173.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.374 1.47 . . . . 0.0 113.076 -179.748 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 67.1 p 42.74 46.23 4.37 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 126.924 2.09 . . . . 0.0 115.746 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.33 161.85 35.89 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.876 1.27 . . . . 0.0 113.397 -177.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 3.5 ptm -68.68 172.82 5.8 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.605 1.962 . . . . 0.0 113.751 171.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? 59.11 14.84 3.7 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 126.771 2.028 . . . . 0.0 115.04 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -97.36 -23.83 15.92 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.794 1.237 . . . . 0.0 113.924 177.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -150.03 130.67 14.01 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.642 1.177 . . . . 0.0 110.2 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -134.47 167.67 20.35 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.784 1.233 . . . . 0.0 110.504 174.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -133.47 148.98 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.016 1.326 . . . . 0.0 110.238 171.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -96.47 122.08 38.97 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 163.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.9 p -67.08 131.21 45.36 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 168.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -108.08 -0.82 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.63 1.172 . . . . 0.0 111.775 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -153.94 157.54 32.51 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.766 2.026 . . . . 0.0 110.908 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -71.59 163.91 37.43 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.425 2.75 . . . . 0.0 112.876 175.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -143.19 142.1 31.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.914 1.285 . . . . 0.0 110.858 171.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 22.9 m -117.52 104.3 10.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.302 1.441 . . . . 0.0 110.049 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.15 -26.77 67.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.189 1.396 . . . . 0.0 113.768 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.95 -88.66 0.97 Allowed Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.882 1.23 . . . . 0.0 114.135 173.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.9 t -145.16 35.07 1.09 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 112.329 -173.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -113.48 164.38 13.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.685 1.594 . . . . 0.0 111.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -121.11 9.2 10.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.64 1.576 . . . . 0.0 113.664 -178.512 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.1 p -127.09 9.41 6.79 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.181 2.192 . . . . 0.0 112.475 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 20.5 mt -109.77 159.56 17.08 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.881 1.273 . . . . 0.0 112.285 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -122.94 122.07 37.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.323 1.449 . . . . 0.0 110.317 -178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 25.3 p -111.05 145.95 37.59 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.489 1.516 . . . . 0.0 112.192 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -164.22 -176.84 4.64 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.4 1.48 . . . . 0.0 112.197 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.25 166.05 15.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.086 1.755 . . . . 0.0 111.808 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -54.69 138.6 41.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.974 -1.078 . . . . 0.0 111.734 173.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.21 -4.51 77.54 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.501 1.048 . . . . 0.0 113.695 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.07 156.96 26.84 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.982 0.913 . . . . 0.0 111.573 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 81.9 t -121.97 131.86 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.263 1.425 . . . . 0.0 110.478 -172.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.4 mm -122.78 138.24 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.929 1.292 . . . . 0.0 109.538 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.3 m -100.72 123.01 44.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.261 1.024 . . . . 0.0 109.621 176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.25 144.39 55.96 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.439 0.638 . . . . 0.0 111.593 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.56 0.16 10.4 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.495 1.518 . . . . 0.0 112.642 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.4 pt -128.05 154.44 78.52 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.936 1.695 . . . . 0.0 110.686 -175.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.51 -25.95 10.6 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.419 2.746 . . . . 0.0 114.831 -176.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -155.4 162.12 40.85 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.119 1.368 . . . . 0.0 112.37 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.419 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.5 pm0 -72.98 166.35 23.23 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 121.64 11.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.456 174.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.7 t0 53.37 24.31 3.82 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.63 -1.294 . . . . 0.0 114.458 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.97 -4.04 77.31 Favored Glycine 0 CA--C 1.541 1.708 0 C-N-CA 125.683 1.611 . . . . 0.0 115.888 -172.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.488 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -88.13 132.97 34.12 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.596 1.958 . . . . 0.0 111.82 173.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -120.81 152.84 37.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.697 1.999 . . . . 0.0 109.428 175.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -123.54 134.42 53.85 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.966 0.889 . . . . 0.0 110.765 -175.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.66 -178.42 37.29 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.108 -0.951 . . . . 0.0 113.485 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -124.51 128.11 48.46 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.716 1.607 . . . . 0.0 109.606 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -68.71 132.37 46.74 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.565 1.146 . . . . 0.0 112.597 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -75.48 9.98 1.91 Allowed 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -125.74 -20.62 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 26.2 t -138.53 -15.29 1.23 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.3 1.44 . . . . 0.0 113.027 -172.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm 62.97 18.24 10.72 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.142 1.777 . . . . 0.0 113.558 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.47 137.95 58.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.316 1.046 . . . . 0.0 110.43 166.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -121.28 153.4 37.73 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.635 1.574 . . . . 0.0 110.779 176.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.75 167.47 25.36 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 123.998 0.809 . . . . 0.0 111.926 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -71.74 131.55 43.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 171.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -125.53 152.14 71.33 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.598 1.159 . . . . 0.0 111.729 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 115.54 4.16 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.422 2.748 . . . . 0.0 112.04 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.496 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.9 t -56.98 -35.7 69.48 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.671 -0.643 . . . . 0.0 112.479 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 21.9 m -60.74 -29.05 69.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -81.75 10.54 6.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.683 170.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 p -138.6 167.33 22.17 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.706 1.602 . . . . 0.0 111.823 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -142.14 150.23 40.82 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.335 1.054 . . . . 0.0 110.599 169.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.09 151.94 17.74 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.414 1.085 . . . . 0.0 111.67 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.3 mt -107.25 13.97 26.62 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.106 1.363 . . . . 0.0 112.191 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.78 -25.28 63.73 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--O 1.253 1.289 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 178.25 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.287 -1.34 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.21 -34.52 21.59 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.023 1.815 . . . . 0.0 113.273 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.15 -35.65 66.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.147 0.579 . . . . 0.0 111.977 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.0 t -61.76 -38.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.97 0.908 . . . . 0.0 111.415 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.22 -28.7 69.55 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.679 -1.263 . . . . 0.0 113.576 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -24.08 64.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.735 0.698 . . . . 0.0 112.207 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -104.75 -20.16 13.7 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.159 2.184 . . . . 0.0 113.263 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 30' ' ' LEU . 58.9 tp -62.77 -49.19 75.96 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.908 0.776 . . . . 0.0 111.455 169.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -60.8 -32.54 71.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -61.51 -42.85 99.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.852 1.261 . . . . 0.0 112.469 171.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -66.92 -50.23 63.05 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.487 0.715 . . . . 0.0 112.548 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.18 -29.79 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.59 -0.693 . . . . 0.0 112.347 -174.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.12 -21.63 65.84 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.885 1.274 . . . . 0.0 113.17 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -78.27 -20.98 50.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.312 1.445 . . . . 0.0 112.449 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -115.99 -1.07 12.6 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.117 1.767 . . . . 0.0 112.283 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.25 64.63 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.956 1.265 . . . . 0.0 115.121 -172.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.493 HG23 HG23 ' A' ' 46' ' ' THR . 34.6 mm -65.54 153.19 8.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.997 1.398 . . . . 0.0 109.723 168.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -149.88 151.03 31.62 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.985 1.314 . . . . 0.0 111.253 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -67.42 158.82 55.24 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.795 2.33 . . . . 0.0 111.286 177.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.41 -22.09 66.68 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -59.36 -13.05 6.9 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.002 1.721 . . . . 0.0 114.932 166.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -140.21 63.51 1.47 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.101 1.76 . . . . 0.0 111.71 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 7.9 ptp -148.3 151.87 36.14 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.937 1.295 . . . . 0.0 112.566 173.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -163.36 167.94 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 112.36 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -139.05 157.04 46.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.964 1.306 . . . . 0.0 113.116 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.57 171.44 10.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.675 1.59 . . . . 0.0 112.722 168.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -125.7 135.24 26.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 125.207 1.403 . . . . 0.0 110.001 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.24 174.06 7.65 Favored 'Trans proline' 0 CA--C 1.55 1.309 1 C-N-CA 125.768 4.312 . . . . 0.0 114.13 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.23 -85.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.914 3.076 . . . . 0.0 113.225 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.511 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 161.12 162.86 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 128.292 2.637 . . . . 0.0 112.677 -175.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.511 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 82.6 Cg_endo -71.46 170.31 18.77 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.961 3.107 . . . . 0.0 113.451 174.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -85.71 4.46 36.56 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.276 1.43 . . . . 0.0 114.604 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 23.0 p90 -137.32 158.69 71.84 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.3 1.44 . . . . 0.0 111.734 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -71.88 158.43 52.86 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 122.897 2.398 . . . . 0.0 113.953 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.42 132.84 94.36 Favored Pre-proline 0 CA--C 1.552 1.024 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.33 167.43 22.27 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.864 3.043 . . . . 0.0 113.053 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.2 p -130.32 151.0 77.75 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.395 1.478 . . . . 0.0 113.121 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.03 169.27 15.34 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 124.565 3.51 . . . . 0.0 113.664 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -71.25 72.65 2.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.091 3.861 . . . . 0.0 112.176 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 11.7 p -138.68 -19.06 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.987 1.315 . . . . 0.0 113.62 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -113.11 20.04 16.64 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.756 1.622 . . . . 0.0 112.559 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -109.79 164.13 12.85 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.55 1.94 . . . . 0.0 112.276 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.2 125.85 25.87 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.666 1.187 . . . . 0.0 112.181 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -71.02 154.7 41.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.893 0.877 . . . . 0.0 112.1 173.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 24.7 t -145.31 143.76 30.36 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.124 1.37 . . . . 0.0 110.632 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 41.41 63.92 5.78 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 126.525 1.93 . . . . 0.0 112.738 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 123.919 3.079 . . . . 0.0 113.182 -178.733 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 t -72.45 -22.27 61.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.198 0.999 . . . . 0.0 113.545 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -133.94 159.66 40.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.397 1.479 . . . . 0.0 111.809 -175.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.0 174.55 9.14 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.897 1.279 . . . . 0.0 113.976 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -118.94 -68.24 0.93 Allowed 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.819 1.648 . . . . 0.0 112.35 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.21 -15.89 63.76 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.3 pt -138.46 -162.88 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 128.207 2.603 . . . . 0.0 108.722 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.03 30.26 4.0 Favored Glycine 0 CA--C 1.536 1.369 0 O-C-N 121.595 -0.69 . . . . 0.0 112.495 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -136.52 -54.28 0.73 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.738 1.615 . . . . 0.0 111.323 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.449 HG11 ' HE1' ' A' ' 51' ' ' TYR . 13.5 p -52.87 136.32 13.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 126.989 2.116 . . . . 0.0 112.456 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.86 79.55 0.25 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 125.462 1.506 . . . . 0.0 109.957 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -123.99 150.78 44.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 0.0 112.917 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.94 142.33 38.13 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 125.001 1.321 . . . . 0.0 114.196 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.66 0.55 6.15 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 124.899 3.733 . . . . 0.0 115.161 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -108.85 -24.26 11.35 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.964 1.306 . . . . 0.0 113.704 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 49.1 p -135.12 -45.32 0.71 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.372 1.069 . . . . 0.0 112.187 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.96 -157.54 18.38 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.868 1.699 . . . . 0.0 113.423 176.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -63.86 145.73 55.27 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.767 0.827 . . . . 0.0 111.228 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -93.09 76.92 4.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.547 1.539 . . . . 0.0 111.709 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -47.67 -41.77 23.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.711 1.204 . . . . 0.0 113.818 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -56.29 -22.84 32.89 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 114.577 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -139.91 21.49 2.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.762 1.625 . . . . 0.0 112.762 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.23 150.3 34.99 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.272 1.034 . . . . 0.0 112.638 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.18 158.04 66.61 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.412 1.485 . . . . 0.0 112.955 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.77 -12.74 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.687 2.925 . . . . 0.0 113.881 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -106.4 -27.67 10.81 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.552 1.141 . . . . 0.0 112.722 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.35 -64.43 0.86 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.818 0.818 . . . . 0.0 110.652 -164.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -32.63 67.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.217 174.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.66 -43.69 88.61 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.754 0.421 . . . . 0.0 111.004 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.31 -45.03 85.96 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.126 0.57 . . . . 0.0 111.174 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.517 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-30 -55.86 -46.2 78.28 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.374 0.534 . . . . 0.0 110.962 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -68.25 -18.25 64.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.358 1.063 . . . . 0.0 113.369 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.5 ttp -89.47 -55.25 3.73 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.146 1.378 . . . . 0.0 112.688 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' A' ' 36' ' ' ILE . 16.9 t -67.18 -25.97 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.809 1.186 . . . . 0.0 111.859 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.21 1.48 10.3 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.377 1.465 . . . . 0.0 114.774 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.426 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -60.86 149.45 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.619 1.567 . . . . 0.0 111.244 177.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.6 t -125.21 165.99 17.28 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.034 0.934 . . . . 0.0 112.732 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -55.61 -28.72 56.81 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.637 1.575 . . . . 0.0 113.54 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.74 98.13 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.304 -0.872 . . . . 0.0 113.215 173.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -68.18 -38.92 82.56 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.012 0.525 . . . . 0.0 110.541 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.517 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.4 mp -63.54 -27.12 69.04 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 126.059 1.744 . . . . 0.0 113.113 176.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -98.2 5.23 48.67 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.822 1.249 . . . . 0.0 112.876 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -91.42 112.52 24.47 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.491 1.116 . . . . 0.0 109.029 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.29 -15.26 23.56 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.041 -1.037 . . . . 0.0 113.658 179.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -96.8 -29.8 13.54 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.819 1.248 . . . . 0.0 112.548 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.498 HG23 HG23 ' C' ' 149' ' ' ILE . 17.6 m -96.84 -52.16 3.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.111 0.964 . . . . 0.0 111.561 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.1 p -54.06 -36.02 62.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.979 1.312 . . . . 0.0 113.057 176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -53.03 -50.32 64.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.366 1.066 . . . . 0.0 112.707 170.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 99.8 t -67.95 -43.19 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.62 0.768 . . . . 0.0 110.481 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.4 -40.73 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 O-C-N 121.995 -0.441 . . . . 0.0 110.268 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.449 ' HE1' HG11 ' A' ' 10' ' ' VAL . 20.2 t80 -64.79 -44.48 89.84 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.989 0.915 . . . . 0.0 112.678 174.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.33 -29.9 64.35 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.427 ' CD2' HD13 ' C' ' 140' ' ' LEU . 28.4 t80 -66.07 -50.65 63.39 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.032 0.533 . . . . 0.0 111.393 170.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.17 -38.72 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 O-C-N 120.822 -1.174 . . . . 0.0 111.049 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -64.93 -16.55 63.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -123.32 -15.23 7.24 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 37.2 m -146.43 -28.7 0.4 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.123 1.369 . . . . 0.0 113.254 -168.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.81 -103.38 0.15 Allowed Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.535 -1.147 . . . . 0.0 110.639 171.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.74 125.74 0.02 OUTLIER Glycine 0 CA--C 1.537 1.432 0 C-N-CA 126.352 1.929 . . . . 0.0 114.467 -176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.21 -31.08 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -178.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.01 -29.77 18.2 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.592 1.157 . . . . 0.0 113.905 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.81 -43.22 84.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.513 1.125 . . . . 0.0 113.142 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 44.5 t -69.25 -24.75 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.621 0.769 . . . . 0.0 111.789 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.79 -24.04 67.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.966 1.306 . . . . 0.0 114.207 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 125.633 1.573 . . . . 0.0 112.785 177.406 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.1 p 52.12 36.78 19.9 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.132 1.373 . . . . 0.0 113.512 -166.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -63.27 -11.26 20.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.577 1.551 . . . . 0.0 114.373 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.1 ptp -126.28 119.94 28.69 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.949 1.7 . . . . 0.0 109.425 170.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -65.56 160.62 22.02 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.638 0.775 . . . . 0.0 111.169 172.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -71.79 19.88 0.06 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 126.155 1.782 . . . . 0.0 114.639 172.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -145.03 136.47 25.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.12 1.768 . . . . 0.0 110.493 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -136.75 170.37 16.19 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.455 1.502 . . . . 0.0 111.106 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.2 155.01 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.753 1.221 . . . . 0.0 111.317 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -104.5 126.04 51.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.176 1.39 . . . . 0.0 108.384 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.8 p -73.85 136.62 43.47 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 168.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.22 -0.88 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.458 1.103 . . . . 0.0 112.052 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -154.18 156.13 31.59 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.961 1.704 . . . . 0.0 111.168 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.23 164.54 35.03 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.7 2.933 . . . . 0.0 112.974 175.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -147.26 147.94 30.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.325 1.45 . . . . 0.0 110.872 173.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.0 m -131.88 118.13 19.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.47 1.508 . . . . 0.0 109.761 -172.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.09 85.86 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -171.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.14 85.94 0.05 OUTLIER Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.202 0.906 . . . . 0.0 114.401 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t 60.23 38.06 20.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.984 1.314 . . . . 0.0 113.929 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -133.83 154.77 50.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.379 1.471 . . . . 0.0 112.034 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 31.1 tptt -126.87 6.13 6.64 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.912 1.685 . . . . 0.0 113.335 -176.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 23.9 p -117.79 9.86 13.09 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.582 1.953 . . . . 0.0 111.743 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 35.1 mt -109.77 159.8 16.87 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.42 1.488 . . . . 0.0 112.023 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.1 tp -120.96 132.17 54.76 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.695 1.598 . . . . 0.0 110.017 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.8 p -121.13 148.83 43.67 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.468 1.507 . . . . 0.0 112.07 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -170.22 -176.03 2.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.865 1.666 . . . . 0.0 111.713 -168.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.19 166.92 13.27 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.035 1.734 . . . . 0.0 111.536 172.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 13.4 tm0? -54.43 138.52 39.83 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.964 -1.085 . . . . 0.0 111.675 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.44 78.65 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.679 1.133 . . . . 0.0 113.849 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -78.8 156.54 28.72 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.107 0.954 . . . . 0.0 111.922 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 71.7 t -118.52 133.49 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 125.656 1.583 . . . . 0.0 110.384 -172.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 16.6 mm -124.31 130.94 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.716 1.206 . . . . 0.0 108.944 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 m -86.33 127.57 34.81 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.416 0.686 . . . . 0.0 109.565 170.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.61 140.7 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.364 0.529 . . . . 0.0 111.025 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.24 -3.28 12.53 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 112.652 177.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -126.05 152.43 73.12 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.103 1.761 . . . . 0.0 110.445 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.61 -24.85 13.3 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.488 2.792 . . . . 0.0 114.631 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.19 159.86 41.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.795 1.638 . . . . 0.0 111.712 -177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.501 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.6 OUTLIER -79.59 173.02 13.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 178.398 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.67 120.43 9.24 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.447 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.29 23.98 3.53 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.49 4.86 85.29 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.422 1.487 . . . . 0.0 115.889 -171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.51 143.37 26.81 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.214 1.406 . . . . 0.0 110.759 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.501 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.1 mt -129.97 150.21 51.35 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.721 2.008 . . . . 0.0 110.084 176.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -121.41 135.28 55.08 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.896 0.855 . . . . 0.0 110.235 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.87 -174.81 33.22 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 115.16 -0.927 . . . . 0.0 113.624 -173.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -127.56 128.85 46.3 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.618 1.567 . . . . 0.0 109.663 177.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.14 130.61 43.46 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.063 0.945 . . . . 0.0 112.574 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.08 4.23 3.72 Favored 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.99 -20.19 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 18.8 t -139.32 -12.56 1.19 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.336 1.455 . . . . 0.0 112.897 -172.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm 61.23 21.27 11.77 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.375 1.87 . . . . 0.0 113.611 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.94 134.12 52.31 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.485 1.114 . . . . 0.0 110.492 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -117.81 151.64 36.93 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.431 1.492 . . . . 0.0 111.513 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.78 169.33 26.03 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.363 0.983 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.49 130.2 39.6 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -120.9 151.24 54.54 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 125.136 1.374 . . . . 0.0 111.525 172.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.88 119.03 5.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.453 2.769 . . . . 0.0 113.438 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.489 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.9 t -55.64 -35.26 65.74 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.367 1.467 . . . . 0.0 113.468 175.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 13.1 m -66.46 -27.77 68.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.989 -1.069 . . . . 0.0 113.855 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -84.74 4.35 33.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.8 1.24 . . . . 0.0 113.572 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 19.3 p -130.02 174.52 9.69 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.509 -1.369 . . . . 0.0 112.264 178.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -149.02 148.39 29.68 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.587 1.155 . . . . 0.0 111.156 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.47 144.52 36.39 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.636 0.775 . . . . 0.0 111.191 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.3 mt -95.7 11.11 34.56 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.438 1.095 . . . . 0.0 112.011 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -55.54 131.87 47.24 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.17 0.988 . . . . 0.0 113.078 172.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.111 1.365 . . . . 0.0 114.621 -178.625 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' C' ' 133' ' ' LEU . 2.5 mm? . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 117.157 -1.401 . . . . 0.0 113.698 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -65.94 -29.26 49.53 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 122.022 1.815 . . . . 0.0 114.117 -169.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -72.49 -35.29 68.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 172.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.6 t -60.36 -35.52 63.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.234 -0.917 . . . . 0.0 111.31 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.29 73.82 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.575 -1.328 . . . . 0.0 114.098 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -70.32 -24.1 62.95 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.366 0.984 . . . . 0.0 112.535 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -96.64 -23.67 16.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.092 1.757 . . . . 0.0 113.223 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 53' ' ' PHE . 67.4 tp -61.04 -47.49 86.15 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.303 0.956 . . . . 0.0 111.662 170.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.1 mtt -57.62 -34.96 69.85 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.554 0.615 . . . . 0.0 112.185 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -64.89 -38.36 90.72 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.456 1.102 . . . . 0.0 112.939 175.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -67.77 -48.92 64.99 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.738 0.699 . . . . 0.0 112.099 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.11 -30.58 71.12 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.037 0.535 . . . . 0.0 112.314 -175.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.15 -21.91 65.79 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.845 1.258 . . . . 0.0 113.232 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -77.79 -20.79 52.65 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.425 1.49 . . . . 0.0 112.307 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.45 -1.04 12.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.236 1.814 . . . . 0.0 112.248 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.44 64.8 Favored Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.022 1.296 . . . . 0.0 114.892 -172.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 46' ' ' THR . 32.5 mm -66.53 152.2 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 118.978 1.389 . . . . 0.0 109.714 169.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -143.54 153.46 58.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.987 1.315 . . . . 0.0 111.412 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.04 158.63 53.33 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.35 2.7 . . . . 0.0 111.461 173.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.04 -13.01 62.02 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.844 -1.16 . . . . 0.0 113.481 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -63.36 -17.96 63.16 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.617 -1.302 . . . . 0.0 114.057 167.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.89 -20.59 57.93 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -108.96 138.48 45.25 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.075 1.35 . . . . 0.0 111.006 -177.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.14 -177.95 6.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.484 1.513 . . . . 0.0 111.479 -176.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -140.0 169.83 16.98 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.409 1.483 . . . . 0.0 112.399 173.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -103.01 173.4 6.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.383 1.873 . . . . 0.0 111.486 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.1 mm -113.42 133.42 22.15 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.299 1.04 . . . . 0.0 109.796 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 172.73 9.35 Favored 'Trans proline' 0 CA--C 1.548 1.213 1 C-N-CA 125.543 4.162 . . . . 0.0 114.028 177.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.6 -76.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.511 2.807 . . . . 0.0 114.01 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.491 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.35 162.51 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.408 3.083 . . . . 0.0 112.574 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.491 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.9 Cg_endo -71.45 169.46 20.81 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.224 3.283 . . . . 0.0 113.499 173.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.44 9.03 25.01 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 20.7 p90 -137.77 158.35 71.75 Favored Pre-proline 0 N--CA 1.474 0.736 0 C-N-CA 125.785 1.634 . . . . 0.0 111.458 176.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.47 157.71 55.72 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.681 2.254 . . . . 0.0 113.457 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.12 129.87 90.96 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.23 157.1 63.24 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.907 3.071 . . . . 0.0 112.827 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.5 p -111.7 149.37 40.65 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.062 1.345 . . . . 0.0 113.02 -172.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.57 165.48 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.594 3.53 . . . . 0.0 114.09 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.25 76.81 1.3 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 125.0 3.8 . . . . 0.0 112.081 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.7 t -136.48 146.59 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.667 1.587 . . . . 0.0 109.097 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -137.04 172.1 13.51 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.207 1.403 . . . . 0.0 111.78 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -141.63 148.03 38.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.413 1.085 . . . . 0.0 111.436 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -154.85 168.78 25.76 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.882 1.673 . . . . 0.0 111.577 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -63.3 161.04 14.61 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.158 0.983 . . . . 0.0 112.269 173.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 82.3 p -117.71 37.48 3.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.535 1.534 . . . . 0.0 112.349 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 47.99 64.14 9.09 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.13 2.172 . . . . 0.0 113.301 -176.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.207 3.271 . . . . 0.0 113.277 -178.604 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -148.41 165.63 30.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.86 1.264 . . . . 0.0 112.637 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.2 p30 -151.85 176.0 11.89 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.775 1.63 . . . . 0.0 112.594 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.52 167.38 5.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.76 -68.12 0.95 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.43 1.492 . . . . 0.0 112.69 -176.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.33 -16.37 64.22 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 177.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.5 pt -137.66 -162.04 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 128.041 2.536 . . . . 0.0 108.611 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 106.1 30.71 4.37 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.543 -0.723 . . . . 0.0 112.407 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -137.49 -50.32 0.61 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.877 1.671 . . . . 0.0 111.611 -172.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG11 ' HE1' ' A' ' 51' ' ' TYR . 7.6 p -55.82 146.88 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 126.699 1.999 . . . . 0.0 112.395 174.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -117.93 85.87 0.4 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.484 1.516 . . . . 0.0 109.632 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 59.8 t90 -131.23 150.22 52.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.015 0.926 . . . . 0.0 113.145 171.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -138.09 144.72 44.72 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 173.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.24 3.58 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.844 1 C-N-CA 125.402 4.068 . . . . 0.0 115.621 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -114.51 -26.53 7.89 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.071 1.348 . . . . 0.0 113.486 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 79.6 p -131.86 -26.05 2.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.224 1.009 . . . . 0.0 113.039 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.24 -159.48 19.35 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.685 1.136 . . . . 0.0 113.901 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -63.84 147.63 51.37 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.84 0.829 . . . . 0.0 111.533 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -94.57 75.17 3.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.995 1.718 . . . . 0.0 112.055 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -48.65 -41.39 31.17 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.038 1.335 . . . . 0.0 114.001 -173.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -58.65 -21.15 53.21 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.226 1.41 . . . . 0.0 114.367 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -138.91 21.72 2.65 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.475 1.51 . . . . 0.0 112.709 -176.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.5 mt -61.84 150.93 35.86 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.125 0.964 . . . . 0.0 113.009 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 158.85 67.64 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 125.682 1.593 . . . . 0.0 113.462 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.05 -14.13 42.42 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.997 3.131 . . . . 0.0 114.027 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.92 -18.51 13.06 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.983 0.913 . . . . 0.0 112.687 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.01 -68.18 0.45 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.523 1.129 . . . . 0.0 110.993 -170.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.5 -30.21 60.23 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.715 0.806 . . . . 0.0 112.449 173.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.57 -45.88 77.85 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.781 1.232 . . . . 0.0 110.307 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.31 -42.93 87.59 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.628 0.771 . . . . 0.0 111.268 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.422 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.3 m-30 -56.97 -44.8 83.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.326 0.512 . . . . 0.0 110.695 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.03 -23.33 64.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.192 0.997 . . . . 0.0 113.405 173.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.4 tpp -76.88 -58.14 3.45 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.439 1.096 . . . . 0.0 111.431 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -23.68 61.68 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.91 2.89 13.92 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.166 1.365 . . . . 0.0 114.823 172.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.406 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -62.14 151.86 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 125.869 1.667 . . . . 0.0 110.949 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.2 t -132.38 170.01 15.71 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.461 0.648 . . . . 0.0 112.71 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -52.53 -31.37 35.27 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.131 1.772 . . . . 0.0 113.964 -177.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.07 -44.61 95.32 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.53 -0.731 . . . . 0.0 112.769 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -68.93 -36.44 77.97 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.914 0.486 . . . . 0.0 111.075 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -65.83 -26.53 67.71 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 125.767 1.627 . . . . 0.0 113.427 176.806 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -96.63 1.28 51.0 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.162 1.385 . . . . 0.0 112.9 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -87.66 112.55 22.46 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.827 1.251 . . . . 0.0 109.331 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.8 OUTLIER -60.27 -15.07 21.6 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -98.88 -30.39 12.42 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.838 1.255 . . . . 0.0 112.6 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.504 HG23 HG23 ' C' ' 149' ' ' ILE . 36.6 m -94.74 -51.5 4.68 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.012 0.824 . . . . 0.0 111.802 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.49 -36.56 64.3 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.818 1.247 . . . . 0.0 113.158 176.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -52.75 -49.17 66.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.423 1.089 . . . . 0.0 112.766 170.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.51 -44.06 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 123.555 0.742 . . . . 0.0 110.793 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.8 mt -62.05 -39.9 85.46 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.486 ' HE1' HG11 ' A' ' 10' ' ' VAL . 32.7 t80 -65.98 -45.17 82.64 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.43 1.092 . . . . 0.0 112.823 174.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.15 -30.17 64.23 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.742 0.817 . . . . 0.0 112.878 177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.14 -50.42 64.04 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.322 0.649 . . . . 0.0 111.472 171.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 -38.17 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 O-C-N 120.767 -1.208 . . . . 0.0 111.222 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -65.41 -12.64 54.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.72 -15.35 4.96 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -174.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 32.4 m -147.18 -27.33 0.38 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.033 1.333 . . . . 0.0 112.808 -167.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.58 -115.69 0.14 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 162.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.14 125.06 0.09 OUTLIER Glycine 0 CA--C 1.536 1.349 0 C-N-CA 126.533 2.016 . . . . 0.0 113.414 -170.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.2 p -59.05 -35.98 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.022 -1.281 . . . . 0.0 114.026 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -85.58 -26.55 26.05 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.614 1.166 . . . . 0.0 113.46 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.94 -45.7 66.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.914 1.286 . . . . 0.0 112.541 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.29 -26.72 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.183 0.993 . . . . 0.0 111.785 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -17.26 51.26 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.86 -0.496 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.7 p -68.71 -27.13 65.67 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -88.66 4.52 46.87 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.942 1.697 . . . . 0.0 114.268 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 8.8 ptp -132.79 99.51 4.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.837 1.255 . . . . 0.0 111.654 -176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -125.08 54.14 1.46 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.454 2.302 . . . . 0.0 110.798 -166.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -172.93 2.74 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.376 2.27 . . . . 0.0 110.646 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -54.1 139.04 36.36 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.161 0.985 . . . . 0.0 112.352 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -133.76 165.68 24.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.722 1.209 . . . . 0.0 111.505 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.52 152.11 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.723 1.609 . . . . 0.0 110.338 172.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.41 125.62 42.16 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 164.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.2 p -67.71 141.49 56.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 167.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.75 -3.8 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.627 1.171 . . . . 0.0 111.909 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -153.77 157.41 32.6 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.312 1.845 . . . . 0.0 111.268 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.8 162.96 40.4 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.541 2.827 . . . . 0.0 113.331 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -148.94 153.14 37.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.407 1.483 . . . . 0.0 110.895 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 59.6 m -141.63 124.1 15.8 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.587 1.555 . . . . 0.0 110.376 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.68 67.09 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.55 72.05 0.74 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.037 0.827 . . . . 0.0 114.817 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 1.5 t 76.65 34.33 0.46 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.05 1.74 . . . . 0.0 113.977 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -129.4 145.4 51.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.427 1.491 . . . . 0.0 111.384 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 5.84 25.69 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.897 1.679 . . . . 0.0 112.728 177.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.6 p -121.01 6.7 10.33 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.775 2.03 . . . . 0.0 112.357 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -107.78 158.34 17.38 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.8 1.24 . . . . 0.0 111.962 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 47.0 tp -118.19 129.14 55.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.542 1.537 . . . . 0.0 109.888 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 39.1 m -118.74 140.67 49.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.733 1.213 . . . . 0.0 111.179 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -163.26 -177.88 5.62 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.281 1.432 . . . . 0.0 112.437 -170.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.23 -177.4 3.32 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.857 1.663 . . . . 0.0 111.547 171.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -69.12 146.67 52.33 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.58 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.23 89.78 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.796 1.188 . . . . 0.0 113.751 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -74.55 165.59 24.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.566 1.146 . . . . 0.0 112.25 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 72.6 t -128.89 129.53 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.834 1.253 . . . . 0.0 110.029 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.7 mm -125.05 132.44 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.033 1.333 . . . . 0.0 108.615 -178.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 60.6 m -96.13 128.54 43.12 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.557 0.743 . . . . 0.0 109.553 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.09 149.5 48.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.66 0.743 . . . . 0.0 111.415 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.8 mt -120.05 -2.29 10.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.401 1.48 . . . . 0.0 112.078 176.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.413 HG22 HG13 ' C' ' 159' ' ' ILE . 45.9 pt -124.77 152.96 70.33 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.261 1.824 . . . . 0.0 110.772 -174.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.54 -25.06 9.92 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.712 2.941 . . . . 0.0 114.984 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.12 164.79 37.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.666 1.586 . . . . 0.0 111.826 -176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.608 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -84.92 169.95 13.56 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.98 119.49 9.08 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.47 0.708 . . . . 0.0 111.448 -178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.3 t0 54.03 25.26 5.35 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.07 4.42 78.02 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.912 1.72 . . . . 0.0 115.951 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -90.98 143.48 26.67 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.481 1.513 . . . . 0.0 111.015 170.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.608 HD21 ' HB3' ' B' ' 104' ' ' GLU . 31.5 mt -131.73 149.61 52.42 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.949 2.1 . . . . 0.0 110.718 177.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -123.0 134.78 54.31 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.949 0.88 . . . . 0.0 110.905 -176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.84 -177.07 36.35 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.403 -168.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -128.41 129.82 46.74 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.582 1.553 . . . . 0.0 109.835 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -68.79 131.44 45.15 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.45 1.1 . . . . 0.0 112.468 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.64 6.08 2.68 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.21 -19.61 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -139.34 -13.82 1.15 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.332 1.453 . . . . 0.0 113.117 -171.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp 61.74 19.28 10.41 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.323 1.849 . . . . 0.0 113.898 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.29 132.08 49.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.531 1.132 . . . . 0.0 110.396 168.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -116.67 153.68 31.89 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.324 1.45 . . . . 0.0 111.743 173.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 163.32 169.24 26.5 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.667 1.127 . . . . 0.0 111.833 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.65 127.45 32.6 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 171.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -115.28 151.53 45.92 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 124.807 1.243 . . . . 0.0 111.209 171.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 73.9 Cg_endo -74.19 120.02 6.09 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 123.247 2.631 . . . . 0.0 112.596 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 28.7 t -53.84 -39.69 65.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.643 1.177 . . . . 0.0 112.909 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.2 m -58.04 -34.8 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.78 1.632 . . . . 0.0 114.086 -177.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -84.3 9.91 11.84 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.457 1.503 . . . . 0.0 113.082 176.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 23.0 p -135.75 163.97 28.96 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.708 -1.245 . . . . 0.0 112.477 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -139.42 145.58 39.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.512 1.125 . . . . 0.0 110.888 172.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.2 pp -55.24 152.66 7.92 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.941 1.296 . . . . 0.0 113.238 175.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.0 11.15 18.94 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.581 1.552 . . . . 0.0 112.276 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -64.54 121.17 13.79 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.695 0.798 . . . . 0.0 111.069 170.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.255 1.352 0 C-N-CA 125.534 1.534 . . . . 0.0 112.688 -176.568 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.382 -1.294 . . . . 0.0 112.795 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -70.16 -33.68 14.64 Favored 'Trans proline' 0 C--N 1.357 1.006 0 CA-C-N 121.927 1.724 . . . . 0.0 113.748 -167.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -72.42 -30.07 64.29 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 82.5 t -66.0 -37.2 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.206 1.002 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.57 -30.89 71.69 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.697 -1.252 . . . . 0.0 113.736 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -70.42 -24.71 62.96 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.246 -0.909 . . . . 0.0 112.139 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -96.97 -24.87 15.61 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.575 1.95 . . . . 0.0 113.401 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 36' ' ' ILE . 59.3 tp -60.6 -49.7 76.47 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.245 0.93 . . . . 0.0 111.525 171.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 21.0 mtm -59.94 -32.57 70.92 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.65 -39.83 91.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 0.0 112.498 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -66.82 -48.49 68.76 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.05 0.841 . . . . 0.0 112.433 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.7 mt -62.96 -30.16 71.36 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.71 -0.619 . . . . 0.0 112.274 -174.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.46 65.54 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.85 1.26 . . . . 0.0 113.265 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -78.52 -20.92 49.67 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.445 1.498 . . . . 0.0 112.398 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -115.13 -1.19 13.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.109 1.763 . . . . 0.0 112.279 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.99 16.74 64.57 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.913 1.244 . . . . 0.0 114.832 -172.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.504 HG23 HG23 ' A' ' 46' ' ' THR . 31.9 mm -65.35 150.33 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 118.967 1.384 . . . . 0.0 109.626 168.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -140.86 152.84 66.65 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.157 1.383 . . . . 0.0 111.224 172.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.09 158.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.88 2.387 . . . . 0.0 111.792 172.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.63 -14.81 62.9 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -65.49 -21.1 66.6 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 168.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.9 -39.84 19.33 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 -173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.4 ptp -64.78 155.18 34.67 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.949 0.9 . . . . 0.0 111.829 167.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.47 178.34 10.41 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.39 . . . . 0.0 112.096 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -138.49 159.79 41.2 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.829 1.651 . . . . 0.0 111.991 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.11 -50.73 6.79 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 -171.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . 0.413 HG13 HG22 ' B' ' 101' ' ' ILE . 9.7 mm 62.9 133.63 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 127.247 2.219 . . . . 0.0 113.479 -170.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.94 172.54 9.59 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.921 3.748 . . . . 0.0 113.563 175.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.87 -82.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.532 2.821 . . . . 0.0 113.526 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 156.16 162.38 0.01 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.917 2.887 . . . . 0.0 112.262 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -70.95 170.87 16.95 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.864 3.043 . . . . 0.0 113.504 174.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.42 7.55 32.13 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.224 1.41 . . . . 0.0 114.304 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 19.7 p90 -138.05 157.61 72.68 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 125.676 1.591 . . . . 0.0 111.285 176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.85 159.63 51.97 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.472 2.114 . . . . 0.0 113.128 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.43 133.7 88.46 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 121.97 -0.456 . . . . 0.0 111.7 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 36.4 Cg_endo -64.05 175.43 3.16 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 124.055 3.17 . . . . 0.0 112.758 175.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.1 p -130.76 149.12 72.72 Favored Pre-proline 0 N--CA 1.477 0.885 0 C-N-CA 124.989 1.315 . . . . 0.0 112.783 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 165.21 30.28 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.406 3.404 . . . . 0.0 113.708 -176.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.24 71.24 2.33 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 125.159 3.906 . . . . 0.0 112.359 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.1 t -137.32 147.19 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.642 1.577 . . . . 0.0 109.138 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -132.54 159.66 38.8 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.082 1.353 . . . . 0.0 111.351 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -66.95 104.61 1.41 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.366 1.067 . . . . 0.0 111.498 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -150.69 117.66 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.23 1.412 . . . . 0.0 110.22 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -72.75 161.8 30.29 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.27 1.028 . . . . 0.0 112.397 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -110.34 1.27 18.36 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.114 1.366 . . . . 0.0 114.396 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -141.53 71.41 25.89 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.874 1.67 . . . . 0.0 110.47 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.254 1.275 0 C-N-CA 123.847 3.031 . . . . 0.0 113.019 178.271 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.556 -0.58 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -161.11 149.57 16.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.06 1.344 . . . . 0.0 111.48 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -146.83 166.11 27.68 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.275 1.83 . . . . 0.0 111.52 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -62.52 166.29 5.38 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 172.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.608 1.563 . . . . 0.0 112.447 -177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.15 -14.43 62.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 pt -142.1 -171.55 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 127.759 2.424 . . . . 0.0 109.269 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.97 -28.63 7.22 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.262 0.934 . . . . 0.0 112.095 173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -59.86 -31.13 69.48 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.35 1.86 . . . . 0.0 114.068 173.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.62 -21.64 22.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -164.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.8 18.85 54.39 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 126.403 1.954 . . . . 0.0 117.131 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.4 t90 -77.02 148.41 36.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.526 1.163 . . . . 0.0 111.965 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -137.27 143.91 43.51 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 172.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.36 2.17 4.12 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.227 3.951 . . . . 0.0 115.379 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -113.31 -26.33 8.43 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.143 1.377 . . . . 0.0 113.77 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.1 p -133.76 -36.52 0.94 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.344 1.058 . . . . 0.0 113.073 -171.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 115.85 -163.82 12.29 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 125.006 1.288 . . . . 0.0 114.543 176.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -59.27 143.23 49.87 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.522 1.129 . . . . 0.0 111.642 175.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.75 66.92 5.37 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.447 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.1 mm? -42.12 -43.97 3.49 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -56.2 -28.17 57.3 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.61 1.564 . . . . 0.0 114.517 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -137.53 20.0 2.91 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.044 1.338 . . . . 0.0 113.774 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.28 151.03 7.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.091 1.356 . . . . 0.0 112.942 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 157.15 64.69 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.229 1.011 . . . . 0.0 113.075 -178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.53 -13.73 41.3 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 124.114 3.21 . . . . 0.0 114.053 -176.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -106.61 -27.23 10.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.18 1.392 . . . . 0.0 112.383 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.15 -64.36 0.9 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.846 0.859 . . . . 0.0 111.421 -164.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.13 -31.52 61.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.785 172.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -68.62 -47.01 67.75 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.156 0.982 . . . . 0.0 110.809 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.675 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.68 -44.54 96.75 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.099 1.76 . . . . 0.0 111.83 168.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -58.92 -45.48 90.24 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.566 0.621 . . . . 0.0 110.412 -176.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.68 -20.29 61.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 13.0 tpp -70.04 -56.41 7.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.54 1.136 . . . . 0.0 111.455 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -66.84 -33.13 74.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.903 0.481 . . . . 0.0 110.958 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.86 3.89 9.77 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.354 1.454 . . . . 0.0 114.33 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.6 mp -58.1 144.87 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-N 118.739 1.269 . . . . 0.0 110.116 174.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -118.08 164.62 14.84 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.769 0.828 . . . . 0.0 112.152 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -56.21 -26.67 51.91 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.871 1.268 . . . . 0.0 113.409 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.71 -44.11 96.99 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -70.41 -37.58 74.47 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.461 0.705 . . . . 0.0 110.952 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.8 mp -64.58 -25.74 68.1 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 125.737 1.615 . . . . 0.0 113.149 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -94.76 -1.72 52.38 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.551 1.54 . . . . 0.0 113.35 173.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -86.81 112.75 22.02 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.136 0.974 . . . . 0.0 109.117 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.13 -14.23 16.0 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.036 -1.04 . . . . 0.0 113.643 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -101.77 -28.29 12.54 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.171 1.388 . . . . 0.0 112.575 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.485 HG23 HG23 ' C' ' 149' ' ' ILE . 32.6 m -95.68 -51.97 4.29 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.141 0.882 . . . . 0.0 111.527 176.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -54.0 -37.34 63.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.586 1.154 . . . . 0.0 113.242 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -52.92 -49.22 66.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.674 1.19 . . . . 0.0 112.817 171.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.04 -45.02 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.228 0.611 . . . . 0.0 110.716 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.29 -40.99 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 O-C-N 122.23 -0.294 . . . . 0.0 110.268 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -65.31 -42.53 92.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.472 1.109 . . . . 0.0 112.981 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -57.1 -30.86 64.71 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.671 -0.643 . . . . 0.0 112.508 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -66.91 -46.56 74.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.229 0.612 . . . . 0.0 112.194 171.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 mt -63.54 -39.08 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 121.177 -0.952 . . . . 0.0 111.188 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.53 -16.21 60.11 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.28 1.032 . . . . 0.0 113.315 177.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.21 -10.85 5.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -171.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -149.65 -29.88 0.24 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.272 1.429 . . . . 0.0 113.113 -170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.68 -118.05 0.09 OUTLIER Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 163.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.89 126.41 0.09 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 126.273 1.892 . . . . 0.0 112.875 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.28 -35.27 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -31.1 23.88 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.416 1.086 . . . . 0.0 113.695 176.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.63 -47.53 72.3 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.407 1.483 . . . . 0.0 112.9 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.35 -27.34 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.148 0.979 . . . . 0.0 111.961 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -10.69 58.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.58 1.952 . . . . 0.0 115.059 175.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 125.51 1.524 . . . . 0.0 112.775 -178.201 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 60.8 p -111.93 149.58 31.7 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.811 1.245 . . . . 0.0 111.706 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -157.14 161.48 39.37 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.259 1.424 . . . . 0.0 110.308 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 7.8 ptp -56.18 134.08 52.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.262 1.025 . . . . 0.0 113.122 176.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -137.04 10.72 3.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 126.801 2.04 . . . . 0.0 113.042 -176.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.39 -41.61 63.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.194 1.397 . . . . 0.0 113.345 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -164.92 139.24 5.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.589 1.956 . . . . 0.0 109.427 170.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -133.92 163.45 29.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.785 1.234 . . . . 0.0 110.866 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -134.59 152.66 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.017 1.327 . . . . 0.0 110.332 174.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -98.9 126.37 44.55 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 166.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.4 p -70.31 139.39 52.05 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.84 -2.99 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.894 -1.129 . . . . 0.0 111.632 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -153.96 158.64 32.51 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 126.594 1.958 . . . . 0.0 111.018 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -71.92 165.22 33.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.274 2.649 . . . . 0.0 112.495 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -145.73 147.17 31.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.157 1.383 . . . . 0.0 110.185 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 14.0 t -124.12 130.94 53.41 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.762 1.225 . . . . 0.0 111.25 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.53 65.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 54.87 49.31 62.57 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 115.065 0.786 . . . . 0.0 115.065 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 2.6 t 77.02 51.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.232 1.813 . . . . 0.0 113.47 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -136.13 161.43 35.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.246 1.418 . . . . 0.0 112.521 177.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -116.78 -4.19 11.64 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 126.089 1.756 . . . . 0.0 113.322 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 29.4 p -113.86 10.34 17.71 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.525 1.93 . . . . 0.0 111.73 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.17 158.23 20.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.211 1.405 . . . . 0.0 112.316 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.6 tp -120.73 128.64 53.12 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.621 1.568 . . . . 0.0 110.157 -176.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.3 p -117.38 145.37 44.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.045 1.338 . . . . 0.0 112.125 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -165.07 -178.03 4.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.052 1.741 . . . . 0.0 111.306 -171.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.44 -178.33 3.6 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.347 1.459 . . . . 0.0 111.223 169.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -67.91 146.26 53.79 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.184 -0.947 . . . . 0.0 111.385 165.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.65 0.58 89.25 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.776 1.179 . . . . 0.0 113.718 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -77.73 166.36 23.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.694 1.198 . . . . 0.0 112.484 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 85.4 t -127.91 130.76 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 125.12 1.368 . . . . 0.0 110.07 -174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -125.72 136.63 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.187 1.395 . . . . 0.0 109.014 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.6 m -100.81 127.19 47.36 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.845 0.858 . . . . 0.0 110.251 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.21 139.69 46.43 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.445 0.641 . . . . 0.0 111.53 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.2 mt -111.19 -4.29 15.07 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.661 1.584 . . . . 0.0 112.466 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 44.8 pt -121.4 152.47 57.86 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.359 1.863 . . . . 0.0 110.38 -175.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -25.3 11.88 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.447 2.765 . . . . 0.0 114.485 -176.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -155.44 159.64 39.99 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.948 1.699 . . . . 0.0 111.555 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -77.83 172.81 12.89 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.28 120.5 9.53 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.231 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.8 t0 53.59 23.88 3.83 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.65 4.2 87.55 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.4 1.476 . . . . 0.0 115.711 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -91.11 143.25 26.89 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 125.337 1.455 . . . . 0.0 110.973 168.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.9 mt -130.92 150.46 52.06 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.752 2.021 . . . . 0.0 110.535 177.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.71 131.48 53.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.978 0.894 . . . . 0.0 110.731 -175.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.84 -179.02 35.32 Favored Glycine 0 CA--C 1.524 0.603 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.688 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -123.44 129.53 51.39 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.449 1.5 . . . . 0.0 109.376 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.2 t-80 -69.91 129.57 39.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.182 0.993 . . . . 0.0 112.448 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.06 -3.17 12.12 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -174.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.412 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -126.42 -18.88 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 C-N-CA 125.019 1.328 . . . . 0.0 114.292 -172.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 29.6 t -127.97 -19.88 3.93 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.263 1.825 . . . . 0.0 111.78 -172.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? 61.73 14.92 6.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.283 2.233 . . . . 0.0 113.082 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.08 58.05 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.352 1.461 . . . . 0.0 111.081 168.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 32.9 mtm105 -121.07 152.08 39.07 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.134 1.773 . . . . 0.0 111.904 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.98 168.21 26.77 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.498 1.047 . . . . 0.0 111.972 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.27 130.57 41.11 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 170.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -119.9 150.94 51.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 125.037 1.335 . . . . 0.0 111.18 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . 0.404 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 60.4 Cg_endo -73.12 120.29 6.51 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.415 2.744 . . . . 0.0 112.771 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.476 ' HB2' HD12 ' B' ' 109' ' ' LEU . 18.3 t -53.77 -41.7 67.48 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.819 1.248 . . . . 0.0 112.836 176.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -63.25 -27.37 69.29 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -84.39 9.51 13.04 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.968 1.307 . . . . 0.0 113.391 171.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 24.8 p -136.18 165.3 26.04 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.406 -1.434 . . . . 0.0 112.179 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -140.24 147.69 40.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.47 1.108 . . . . 0.0 110.679 170.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.13 145.66 36.06 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.109 0.964 . . . . 0.0 111.756 175.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.85 10.2 40.78 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.79 1.236 . . . . 0.0 112.096 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -55.92 140.17 43.76 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.221 1.009 . . . . 0.0 113.051 171.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 C--O 1.254 1.31 0 C-N-CA 125.184 1.393 . . . . 0.0 112.976 -175.422 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.5 2.053 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.229 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.49 -30.69 43.31 Favored 'Trans proline' 0 C--N 1.355 0.914 0 C-N-CA 122.013 1.809 . . . . 0.0 113.624 -167.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -74.7 -31.47 61.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.737 0.815 . . . . 0.0 112.49 174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.59 -36.92 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 121.335 -0.853 . . . . 0.0 111.407 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.46 69.92 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.949 -1.095 . . . . 0.0 113.587 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.93 -29.53 67.79 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.25 0.932 . . . . 0.0 111.859 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -91.29 -25.78 19.29 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.171 1.788 . . . . 0.0 112.918 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.675 HD22 HD11 ' A' ' 30' ' ' LEU . 58.2 tp -61.55 -48.49 80.73 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.738 0.699 . . . . 0.0 111.841 171.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.0 mtm -60.76 -29.48 69.43 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -66.14 -40.4 90.57 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.12 0.968 . . . . 0.0 112.951 171.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -66.74 -49.27 66.52 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.749 0.704 . . . . 0.0 112.305 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.69 -29.2 70.48 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.803 -0.561 . . . . 0.0 112.336 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.42 -21.55 65.57 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.816 1.246 . . . . 0.0 113.162 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.66 -20.66 53.36 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.303 1.441 . . . . 0.0 112.312 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.84 -0.9 12.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.193 1.797 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.88 17.17 64.9 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 124.915 1.245 . . . . 0.0 115.178 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.485 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.18 150.36 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-N 119.086 1.443 . . . . 0.0 109.748 169.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -145.04 154.3 54.44 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.11 1.364 . . . . 0.0 111.857 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.35 161.79 43.28 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.182 2.588 . . . . 0.0 112.268 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.11 -22.41 65.81 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.234 1.014 . . . . 0.0 113.27 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -72.5 -7.3 49.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.025 1.33 . . . . 0.0 114.026 171.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -118.25 26.86 9.33 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.626 1.57 . . . . 0.0 112.162 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 11.1 ptp -141.5 139.64 33.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.578 1.551 . . . . 0.0 110.774 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -164.04 -174.82 3.74 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.879 1.671 . . . . 0.0 110.701 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -139.06 168.58 19.51 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.133 1.373 . . . . 0.0 112.461 171.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -101.82 171.37 7.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.026 1.73 . . . . 0.0 112.052 177.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.9 mm -122.35 133.81 24.56 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.689 1.196 . . . . 0.0 109.558 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.13 172.86 9.32 Favored 'Trans proline' 0 CA--C 1.548 1.191 1 C-N-CA 125.554 4.169 . . . . 0.0 113.768 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.77 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.446 2.764 . . . . 0.0 113.762 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.19 162.84 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.342 3.057 . . . . 0.0 112.692 -173.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.5 Cg_endo -71.1 169.99 19.23 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.184 3.256 . . . . 0.0 113.662 173.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -85.47 3.13 41.66 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.201 1.401 . . . . 0.0 114.668 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -135.42 158.49 74.36 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.294 1.438 . . . . 0.0 111.635 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.14 157.46 57.43 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.642 2.228 . . . . 0.0 113.367 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.57 130.3 91.96 Favored Pre-proline 0 CA--C 1.55 0.961 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 52.9 Cg_endo -67.97 159.52 52.58 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.711 2.94 . . . . 0.0 112.837 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.9 p -115.97 149.49 43.4 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.179 1.391 . . . . 0.0 112.971 -172.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.96 165.35 26.46 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.51 3.473 . . . . 0.0 113.92 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -71.67 68.59 2.91 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 125.292 3.995 . . . . 0.0 112.4 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 64.4 t -136.46 148.68 27.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.672 1.589 . . . . 0.0 108.907 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -119.25 149.65 41.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.575 1.15 . . . . 0.0 111.627 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -104.29 -15.65 15.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.971 0.908 . . . . 0.0 112.675 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 46.45 42.3 10.61 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.336 1.855 . . . . 0.0 113.267 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -122.11 152.25 40.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.093 1.357 . . . . 0.0 112.389 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 22.5 t -160.86 146.17 14.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.107 1.363 . . . . 0.0 110.544 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 40.71 56.18 7.81 Favored Pre-proline 0 N--CA 1.483 1.216 0 C-N-CA 126.659 1.984 . . . . 0.0 114.167 175.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--O 1.256 1.403 0 C-N-CA 124.152 3.234 . . . . 0.0 113.618 -174.935 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -58.8 130.98 49.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.512 1.125 . . . . 0.0 112.777 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -112.52 89.23 3.01 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.223 1.409 . . . . 0.0 109.992 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -138.06 171.58 14.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.445 1.498 . . . . 0.0 112.515 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -118.02 -67.09 1.02 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.569 1.548 . . . . 0.0 112.16 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -15.54 63.51 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 177.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.63 -170.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 127.847 2.459 . . . . 0.0 109.238 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.97 -27.51 4.06 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.734 1.159 . . . . 0.0 111.818 172.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.9 -36.5 74.78 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.016 1.726 . . . . 0.0 113.672 170.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.9 t -77.92 128.69 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.687 1.195 . . . . 0.0 109.996 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.47 26.1 21.04 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.741 1.639 . . . . 0.0 114.681 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -67.03 150.14 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.971 1.308 . . . . 0.0 111.995 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.81 144.28 49.91 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 170.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.89 1.82 4.17 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 125.065 3.844 . . . . 0.0 115.31 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -108.28 -32.52 7.44 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.7 p -129.05 -25.91 2.69 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.583 1.153 . . . . 0.0 113.474 -169.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.36 -162.62 16.82 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.538 1.066 . . . . 0.0 114.263 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.15 151.31 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.308 1.043 . . . . 0.0 111.569 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -89.96 66.7 6.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.237 1.815 . . . . 0.0 113.291 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.517 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -47.11 -41.29 17.11 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -174.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -60.52 -21.19 62.2 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -135.74 17.06 3.31 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.718 1.207 . . . . 0.0 113.943 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -58.75 151.66 20.7 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.485 1.114 . . . . 0.0 113.799 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.44 158.66 72.13 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 125.213 1.405 . . . . 0.0 113.646 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.34 -9.55 26.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.364 3.376 . . . . 0.0 114.498 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.01 -16.98 9.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.844 1.258 . . . . 0.0 112.988 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.58 -66.78 0.56 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.063 0.945 . . . . 0.0 111.384 -173.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.1 -32.94 64.64 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.97 0.729 . . . . 0.0 112.97 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.523 ' HB3' HD21 ' C' ' 133' ' ' LEU . 32.8 m-20 -65.7 -43.86 87.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.789 0.436 . . . . 0.0 111.338 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.628 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -43.36 92.81 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.255 1.022 . . . . 0.0 110.971 173.304 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.1 m-85 -59.67 -45.85 90.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.559 -177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.98 -24.27 63.29 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.991 0.916 . . . . 0.0 113.234 177.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.1 tpp -69.28 -53.92 17.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.2 1.0 . . . . 0.0 110.924 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 36' ' ' ILE . 37.5 t -71.05 -27.82 63.93 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.814 0.445 . . . . 0.0 111.897 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.31 9.85 12.59 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.188 1.375 . . . . 0.0 114.691 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.64 144.75 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 118.596 1.198 . . . . 0.0 109.61 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 t -117.6 163.67 16.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.094 0.958 . . . . 0.0 112.28 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -51.25 -30.81 18.79 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.989 1.316 . . . . 0.0 113.796 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.06 99.43 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 175.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -70.33 -38.37 74.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.048 0.539 . . . . 0.0 110.87 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.482 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.2 mp -63.1 -27.35 69.33 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.961 1.705 . . . . 0.0 113.197 176.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -95.32 -1.86 50.46 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.967 1.307 . . . . 0.0 113.22 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -86.67 112.13 21.34 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.523 1.129 . . . . 0.0 109.403 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.407 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.43 -15.25 15.97 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 121.06 -1.025 . . . . 0.0 113.755 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -100.13 -26.13 14.05 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 112.784 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.506 HG23 HG23 ' C' ' 149' ' ' ILE . 24.0 m -98.62 -51.7 3.84 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.73 0.812 . . . . 0.0 111.145 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 65.5 p -54.91 -35.6 64.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.924 1.29 . . . . 0.0 113.214 177.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 tptm -53.53 -49.59 67.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.128 0.971 . . . . 0.0 112.703 171.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.86 -44.45 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.345 0.658 . . . . 0.0 110.738 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.19 -40.14 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 O-C-N 122.105 -0.372 . . . . 0.0 110.674 178.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.3 -44.78 82.53 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.503 1.121 . . . . 0.0 113.115 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.53 -30.99 61.71 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.436 0.694 . . . . 0.0 112.672 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -66.56 -47.63 72.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.499 0.72 . . . . 0.0 112.529 172.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.81 -37.73 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 O-C-N 120.266 -1.521 . . . . 0.0 110.885 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -67.55 -7.34 25.28 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -11.74 3.52 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.4 m -151.46 -30.14 0.17 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.634 1.173 . . . . 0.0 112.911 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -75.17 -120.77 0.11 Allowed Glycine 0 CA--C 1.53 1.012 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 162.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.1 128.48 0.03 OUTLIER Glycine 0 CA--C 1.536 1.345 0 C-N-CA 127.118 2.294 . . . . 0.0 114.295 -169.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 3.1 t -56.61 -41.01 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 O-C-N 121.289 -1.124 . . . . 0.0 113.787 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.04 -29.52 58.08 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.232 -0.918 . . . . 0.0 112.859 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -74.79 -42.86 57.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.413 1.485 . . . . 0.0 112.961 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 84.1 t -69.53 -28.23 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.621 1.168 . . . . 0.0 111.464 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.52 -21.53 66.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.634 1.573 . . . . 0.0 114.758 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 . . . . . 0 C--O 1.254 1.309 0 C-N-CA 125.43 1.492 . . . . 0.0 113.699 -175.948 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.9 p -138.92 62.95 1.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.878 1.271 . . . . 0.0 112.198 -174.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -59.75 175.59 0.36 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.46 1.104 . . . . 0.0 113.114 168.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 17.5 ptp -49.18 173.11 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.548 1.539 . . . . 0.0 113.863 163.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.14 -19.34 2.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.541 1.536 . . . . 0.0 114.246 177.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 tttp 70.71 36.08 1.67 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 127.853 2.461 . . . . 0.0 111.861 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -149.86 132.65 15.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.71 1.204 . . . . 0.0 110.362 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -134.05 166.84 21.81 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.302 1.441 . . . . 0.0 109.887 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -132.65 151.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.576 1.15 . . . . 0.0 110.014 173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -101.44 126.83 48.28 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 165.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 4.9 p -67.43 141.48 57.0 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -116.6 -2.4 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 120.769 -1.207 . . . . 0.0 111.748 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -153.78 156.2 31.95 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 126.527 1.931 . . . . 0.0 111.34 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.28 164.19 35.9 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.86 3.04 . . . . 0.0 113.161 177.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -148.2 153.08 38.29 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.399 1.479 . . . . 0.0 111.06 173.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 90.5 m -139.97 118.51 12.25 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.484 1.514 . . . . 0.0 110.705 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.1 -32.43 73.88 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -176.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.36 -77.8 0.72 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.499 1.523 . . . . 0.0 115.046 178.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.5 p -138.76 14.0 2.7 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.403 1.481 . . . . 0.0 114.193 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -110.33 160.32 16.66 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.327 1.451 . . . . 0.0 111.979 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -118.0 12.56 13.72 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.382 1.873 . . . . 0.0 112.843 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 39.0 p -124.75 14.89 8.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.746 2.018 . . . . 0.0 111.966 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.2 mt -113.57 155.19 25.86 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.198 1.399 . . . . 0.0 111.795 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -116.01 126.07 53.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.59 1.556 . . . . 0.0 109.744 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.1 m -116.18 142.95 46.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.764 1.226 . . . . 0.0 111.3 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -164.46 -178.22 5.3 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.443 1.497 . . . . 0.0 112.168 -170.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -105.72 -179.7 4.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.431 1.493 . . . . 0.0 111.313 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.35 146.94 54.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.196 0.998 . . . . 0.0 111.28 164.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.68 2.29 89.91 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.317 0.96 . . . . 0.0 113.707 173.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.92 165.93 22.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.813 1.245 . . . . 0.0 112.281 175.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.1 t -129.51 129.94 67.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.837 1.255 . . . . 0.0 110.38 -173.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.3 133.1 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.94 1.296 . . . . 0.0 109.497 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 m -94.49 126.98 40.11 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.248 1.019 . . . . 0.0 109.945 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.3 144.23 50.05 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.051 0.841 . . . . 0.0 112.272 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -119.09 -0.83 11.02 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.381 1.473 . . . . 0.0 112.904 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 45.2 pt -124.39 155.82 68.1 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 125.48 1.512 . . . . 0.0 111.333 -173.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.61 -31.25 11.05 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.359 2.706 . . . . 0.0 114.182 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -156.26 160.88 40.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.574 1.55 . . . . 0.0 111.824 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -75.85 171.8 13.78 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 178.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.99 120.53 9.1 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.39 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.1 25.26 4.04 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.341 -1.474 . . . . 0.0 114.802 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.33 4.08 83.44 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.62 1.581 . . . . 0.0 115.885 -171.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -90.49 142.97 27.2 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.36 1.464 . . . . 0.0 110.921 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.3 mt -130.13 151.13 51.0 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.703 2.001 . . . . 0.0 110.543 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -123.55 131.85 53.74 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.045 0.926 . . . . 0.0 110.801 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.21 34.16 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 114.913 -1.04 . . . . 0.0 113.466 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -125.29 130.59 52.31 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.519 1.528 . . . . 0.0 109.952 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -69.26 128.69 37.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.224 1.009 . . . . 0.0 112.488 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.05 11.58 1.42 Allowed 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -176.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.38 -18.99 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.719 1.208 . . . . 0.0 114.243 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -140.27 -13.56 1.03 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.401 1.48 . . . . 0.0 113.132 -171.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 59.0 mmtt 61.63 20.35 11.23 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.017 1.727 . . . . 0.0 113.815 -177.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.1 134.49 51.93 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.719 1.208 . . . . 0.0 110.746 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -122.21 150.86 41.68 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.887 1.675 . . . . 0.0 111.593 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.29 168.78 26.89 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 124.48 1.038 . . . . 0.0 112.07 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -72.62 129.67 38.8 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 170.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.0 p90 -119.47 151.5 51.6 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.949 1.299 . . . . 0.0 111.485 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.51 119.9 6.2 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.539 2.826 . . . . 0.0 113.547 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.457 ' HB2' HD12 ' B' ' 109' ' ' LEU . 30.2 t -56.43 -36.81 69.4 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.3 1.44 . . . . 0.0 113.487 175.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.0 m -66.47 -26.58 67.26 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.77 5.9 34.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.04 1.336 . . . . 0.0 113.829 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 p -132.34 175.87 8.9 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.4 -1.438 . . . . 0.0 111.79 175.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.39 152.72 33.48 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.254 1.021 . . . . 0.0 111.698 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.52 146.18 36.43 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 112.061 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.07 14.4 29.4 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.888 1.275 . . . . 0.0 111.67 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -58.94 154.7 14.77 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 171.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.826 1.65 . . . . 0.0 113.868 -177.291 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 29' ' ' ASN . 1.9 mt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 117.132 -1.413 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.06 -35.56 14.46 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.053 1.835 . . . . 0.0 113.901 -165.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -69.9 -40.85 75.39 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.759 -0.588 . . . . 0.0 112.09 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.11 -41.97 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 124.505 1.122 . . . . 0.0 111.831 -176.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.19 -29.65 69.94 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 176.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.92 -27.57 61.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.357 0.98 . . . . 0.0 111.155 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -76.88 -38.92 52.7 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.946 1.698 . . . . 0.0 111.572 173.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 30' ' ' LEU . 61.4 tp -59.2 -46.44 88.41 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 123.665 0.786 . . . . 0.0 111.893 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 41.9 mtt -59.79 -33.52 71.83 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -177.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.62 -41.95 98.23 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.015 0.926 . . . . 0.0 111.937 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -66.69 -49.62 65.52 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.358 0.663 . . . . 0.0 112.463 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.73 -29.61 70.8 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.755 -0.591 . . . . 0.0 112.317 -175.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.55 -21.31 65.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.669 1.187 . . . . 0.0 113.225 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.07 -20.25 52.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.46 1.504 . . . . 0.0 112.497 -178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -117.73 -0.7 11.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.215 1.806 . . . . 0.0 112.298 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.92 17.57 63.29 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.96 1.267 . . . . 0.0 115.151 -171.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 46' ' ' THR . 34.3 mm -65.92 155.36 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 119.055 1.428 . . . . 0.0 109.791 168.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.01 157.85 32.97 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.001 1.321 . . . . 0.0 111.578 176.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.59 158.11 54.41 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.102 2.535 . . . . 0.0 111.822 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -23.87 67.52 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.141 -0.974 . . . . 0.0 113.121 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.58 -16.61 2.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.03 1.732 . . . . 0.0 114.689 165.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -116.33 20.21 14.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.885 1.674 . . . . 0.0 111.847 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 39.9 mtm -118.06 126.43 52.25 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.948 1.299 . . . . 0.0 112.1 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.31 157.87 26.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.351 1.46 . . . . 0.0 111.517 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.2 170.75 19.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.091 1.356 . . . . 0.0 113.167 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -99.73 175.6 5.75 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.675 1.99 . . . . 0.0 112.636 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 14.7 mm -122.85 135.25 25.59 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.234 1.413 . . . . 0.0 109.661 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 172.98 10.11 Favored 'Trans proline' 0 CA--C 1.55 1.314 1 C-N-CA 125.647 4.231 . . . . 0.0 114.136 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.34 -77.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.752 2.968 . . . . 0.0 114.02 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.488 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.49 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 129.322 3.049 . . . . 0.0 112.711 -173.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.488 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.2 Cg_endo -71.6 170.93 17.38 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.289 3.326 . . . . 0.0 113.983 174.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.74 0.27 44.33 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.566 1.546 . . . . 0.0 114.834 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -136.12 158.42 73.75 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 125.469 1.508 . . . . 0.0 111.487 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -71.37 158.99 52.96 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.573 2.182 . . . . 0.0 113.459 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.52 130.22 91.82 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.83 158.71 56.08 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.877 3.051 . . . . 0.0 112.879 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 18.4 p -114.76 148.46 40.44 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 125.071 1.348 . . . . 0.0 113.095 -172.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.73 167.57 20.82 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.744 3.629 . . . . 0.0 114.047 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.17 70.58 1.79 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 125.188 3.925 . . . . 0.0 112.633 174.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 79.8 t -126.57 -30.54 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.674 1.19 . . . . 0.0 112.694 -175.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.22 135.31 38.42 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.675 1.19 . . . . 0.0 112.61 174.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -158.01 153.32 25.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.311 1.045 . . . . 0.0 111.378 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -72.78 105.63 4.42 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.09 0.956 . . . . 0.0 110.908 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -64.24 132.1 49.31 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.415 0.686 . . . . 0.0 111.943 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 51.8 m -149.59 149.9 31.39 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.764 1.625 . . . . 0.0 110.803 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? 37.55 59.87 4.27 Favored Pre-proline 0 N--CA 1.483 1.219 0 C-N-CA 126.868 2.067 . . . . 0.0 113.802 -177.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo . . . . . 0 C--O 1.253 1.265 0 C-N-CA 123.702 2.935 . . . . 0.0 113.061 -178.838 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -75.68 53.34 0.71 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.241 1.817 . . . . 0.0 113.107 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -131.9 27.62 4.57 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.452 1.901 . . . . 0.0 111.823 -170.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -137.31 175.02 9.98 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.611 1.964 . . . . 0.0 112.323 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -115.92 -63.23 1.48 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.062 1.345 . . . . 0.0 112.972 -176.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.9 -15.23 63.44 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 177.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.1 pt -141.61 -176.93 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.009 2.524 . . . . 0.0 109.309 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.28 -31.25 1.95 Allowed Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.659 1.123 . . . . 0.0 111.301 170.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.47 -48.52 80.49 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.458 1.903 . . . . 0.0 114.372 175.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.6 t -64.48 129.82 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.072 0.949 . . . . 0.0 111.096 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.95 30.12 11.07 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.216 1.389 . . . . 0.0 114.448 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -75.64 150.05 38.05 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.052 0.926 . . . . 0.0 112.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.28 144.03 43.96 Favored Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.56 2.53 3.89 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.457 4.105 . . . . 0.0 115.393 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -111.75 -30.56 7.27 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.66 1.184 . . . . 0.0 113.145 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.1 p -131.31 -30.26 1.73 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.369 1.067 . . . . 0.0 113.634 -168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.88 -160.02 13.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.661 1.124 . . . . 0.0 114.677 175.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -65.41 143.56 57.64 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.056 0.942 . . . . 0.0 111.719 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.16 68.88 9.77 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 122.943 1.354 . . . . 0.0 112.388 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.488 HD21 HD23 ' A' ' 41' ' ' LEU . 12.8 mt -46.74 -34.62 5.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.024 2.53 . . . . 0.0 113.894 178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -53.56 -33.34 54.39 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.488 1.515 . . . . 0.0 113.361 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -148.31 33.81 0.8 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.433 1.493 . . . . 0.0 111.846 -174.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.6 mt -56.83 150.32 16.59 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.435 -0.79 . . . . 0.0 112.756 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.08 155.23 56.56 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.493 1.117 . . . . 0.0 113.701 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.417 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 60.5 Cg_endo -66.41 -10.58 28.15 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.709 3.606 . . . . 0.0 114.43 -176.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -118.09 -14.77 9.92 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.641 1.576 . . . . 0.0 112.843 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -72.26 -69.29 0.41 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.111 0.964 . . . . 0.0 110.852 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 25' ' ' PRO . 0.1 OUTLIER -56.48 -30.95 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -67.34 -47.05 71.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.53 1.132 . . . . 0.0 110.783 -177.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.406 HD21 HD22 ' C' ' 140' ' ' LEU . 12.1 tp -62.71 -44.51 96.05 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.815 0.846 . . . . 0.0 112.015 169.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.452 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.8 m-30 -55.59 -45.03 77.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.931 0.787 . . . . 0.0 110.775 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.22 -22.56 62.9 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 20.3 tpp -74.17 -59.71 2.6 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.327 1.051 . . . . 0.0 111.165 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.6 t -69.68 -28.45 65.87 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 122.2 -0.312 . . . . 0.0 111.759 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.71 9.73 8.95 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 125.041 1.305 . . . . 0.0 114.229 172.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mp -64.13 145.35 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 118.466 1.133 . . . . 0.0 110.824 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.2 t -120.38 164.5 16.25 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.009 0.924 . . . . 0.0 112.628 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -50.91 -32.97 22.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.728 1.611 . . . . 0.0 114.0 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.0 86.22 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 174.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -71.55 -38.44 71.0 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.312 0.645 . . . . 0.0 111.139 177.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.488 HD23 HD21 ' A' ' 20' ' ' LEU . 5.3 mp -64.51 -26.41 68.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.947 1.699 . . . . 0.0 113.366 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -94.61 -3.98 48.61 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.288 1.435 . . . . 0.0 113.093 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -85.1 111.03 19.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.204 1.001 . . . . 0.0 109.172 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.17 -14.2 9.79 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -102.33 -23.05 14.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.305 1.442 . . . . 0.0 113.075 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.499 HG23 HG23 ' C' ' 149' ' ' ILE . 42.9 m -101.79 -50.89 3.56 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.938 0.895 . . . . 0.0 111.339 176.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 p -53.72 -36.48 62.3 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.801 1.24 . . . . 0.0 113.124 175.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -53.43 -49.85 66.47 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.316 1.046 . . . . 0.0 112.662 170.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.3 t -65.74 -45.12 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.552 0.741 . . . . 0.0 110.632 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.5 mt -61.82 -39.35 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 122.139 -0.351 . . . . 0.0 110.355 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -67.66 -45.62 74.74 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.944 -1.097 . . . . 0.0 112.911 175.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -55.74 -31.05 62.2 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.586 0.754 . . . . 0.0 112.56 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -65.56 -50.3 65.66 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.436 0.695 . . . . 0.0 112.1 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.95 -37.44 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 120.65 -1.281 . . . . 0.0 111.106 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.0 -14.55 54.98 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.109 0.964 . . . . 0.0 113.47 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -128.85 -12.8 4.73 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -171.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 m -150.02 -27.09 0.25 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.926 1.29 . . . . 0.0 113.248 -169.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.57 -107.7 0.2 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-O 117.96 -1.467 . . . . 0.0 110.537 169.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.91 126.14 0.01 OUTLIER Glycine 0 CA--C 1.54 1.655 0 C-N-CA 126.643 2.068 . . . . 0.0 115.461 -176.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -53.92 -30.62 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 125.123 1.369 . . . . 0.0 114.479 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -95.78 -28.92 14.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.36 1.464 . . . . 0.0 114.524 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.17 -33.1 74.75 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.396 1.078 . . . . 0.0 113.709 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 30.5 m -79.21 -18.84 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.563 1.545 . . . . 0.0 113.406 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -78.46 -40.48 35.45 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.427 1.491 . . . . 0.0 112.386 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.645 1.578 . . . . 0.0 113.232 178.675 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.466 -0.653 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.7 t -151.63 165.13 35.26 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.192 1.397 . . . . 0.0 111.208 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -110.56 -13.32 14.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 13.5 mmt -78.18 143.3 37.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.956 0.902 . . . . 0.0 111.77 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -132.56 4.21 3.93 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.429 1.492 . . . . 0.0 113.905 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -68.0 -70.95 0.23 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.804 1.242 . . . . 0.0 111.935 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -167.24 151.25 6.7 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.487 1.915 . . . . 0.0 109.751 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -135.44 163.31 30.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.236 1.014 . . . . 0.0 111.65 173.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.3 m -139.55 149.47 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.271 1.428 . . . . 0.0 110.9 174.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -94.66 129.61 41.47 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 167.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.1 p -73.56 137.68 44.48 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 168.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.79 -1.28 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.339 -1.476 . . . . 0.0 112.05 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -152.76 156.39 33.01 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 125.864 1.665 . . . . 0.0 111.211 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -72.51 163.28 39.03 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.818 3.012 . . . . 0.0 113.244 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -144.5 151.77 39.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.027 1.331 . . . . 0.0 111.237 171.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 40.7 m -133.65 111.7 10.83 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.422 1.489 . . . . 0.0 110.61 -169.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.46 -20.93 62.03 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.33 -102.46 0.67 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.367 0.984 . . . . 0.0 113.176 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 39.4 m -124.4 4.4 8.39 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.03 1.332 . . . . 0.0 113.927 -173.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -78.16 165.41 23.98 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.269 1.028 . . . . 0.0 112.435 176.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -123.33 11.2 9.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.796 1.638 . . . . 0.0 113.258 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 35.0 p -126.93 17.32 7.31 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.363 1.865 . . . . 0.0 112.094 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 mt -113.85 156.94 23.02 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.998 1.319 . . . . 0.0 111.893 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.3 tp -119.7 123.56 44.1 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.022 1.329 . . . . 0.0 110.029 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 30.5 p -109.53 146.9 33.87 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.229 1.412 . . . . 0.0 111.847 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -163.69 178.96 7.49 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.525 1.53 . . . . 0.0 111.515 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.25 -177.31 3.29 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.585 1.554 . . . . 0.0 111.203 170.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -68.18 144.85 54.79 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.051 -1.03 . . . . 0.0 111.113 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.75 -0.6 89.17 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.797 1.189 . . . . 0.0 113.883 175.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.98 167.13 22.34 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.831 1.252 . . . . 0.0 112.735 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.8 t -130.73 131.7 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.054 1.342 . . . . 0.0 110.499 -172.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.56 136.32 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.562 1.545 . . . . 0.0 109.086 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 26.3 m -100.13 123.89 44.9 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.192 0.997 . . . . 0.0 109.754 175.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.71 146.02 54.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.822 0.849 . . . . 0.0 111.606 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.94 1.52 9.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.196 1.398 . . . . 0.0 112.584 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.0 pt -128.36 154.63 79.14 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.712 1.605 . . . . 0.0 111.219 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.21 -26.75 8.74 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.445 2.763 . . . . 0.0 114.893 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -155.55 162.44 40.68 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.113 1.365 . . . . 0.0 112.345 -175.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.68 165.66 24.7 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.61 121.69 12.14 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.379 175.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 16.2 t0 53.17 24.28 3.55 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.04 -4.96 78.67 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 125.684 1.611 . . . . 0.0 115.887 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.483 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.4 m95 -88.38 133.81 33.99 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.816 2.047 . . . . 0.0 111.942 174.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.483 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -121.02 153.07 37.84 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.806 2.043 . . . . 0.0 109.462 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -123.51 136.59 54.65 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.892 0.853 . . . . 0.0 110.987 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.84 -175.77 37.28 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 115.086 -0.961 . . . . 0.0 114.169 -170.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -128.84 127.66 42.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.59 1.956 . . . . 0.0 110.224 -178.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.67 130.47 42.92 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.883 0.873 . . . . 0.0 112.627 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -75.75 10.17 1.93 Allowed 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.97 -19.99 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 125.175 1.39 . . . . 0.0 114.416 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.5 t -139.57 -15.33 1.07 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.372 1.469 . . . . 0.0 113.01 -171.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 63.03 18.08 10.63 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.391 1.876 . . . . 0.0 113.723 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.5 137.88 57.71 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.527 1.131 . . . . 0.0 110.495 167.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -120.69 154.9 34.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.145 1.378 . . . . 0.0 111.379 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.35 168.1 25.91 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 124.015 0.817 . . . . 0.0 111.893 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -72.5 132.21 43.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -127.74 153.7 77.89 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.862 1.265 . . . . 0.0 112.4 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.72 117.13 4.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.715 2.943 . . . . 0.0 112.776 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.465 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.5 t -59.4 -27.06 65.67 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.643 -0.66 . . . . 0.0 112.566 169.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.9 m -55.62 -36.15 66.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.86 1.264 . . . . 0.0 113.72 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -89.7 9.33 27.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.762 1.625 . . . . 0.0 113.547 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.1 p -132.05 -178.71 5.02 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.982 1.313 . . . . 0.0 111.744 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 9.8 ptmm? -145.08 -89.79 0.1 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . 0.454 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 2.1 pt? -164.46 171.13 15.06 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.039 2.136 . . . . 0.0 111.415 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 19.2 mt -137.17 31.94 2.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.316 1.846 . . . . 0.0 111.47 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.53 161.49 9.56 Favored 'General case' 0 CA--C 1.552 1.039 0 O-C-N 121.512 -0.742 . . . . 0.0 111.77 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . 0.253 11.3 pt-20 . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 126.84 2.056 . . . . 0.0 115.293 -171.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.64 -32.46 19.0 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.127 1.885 . . . . 0.0 114.038 -163.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -67.84 -50.07 58.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.205 0.457 . . . . 0.0 111.146 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 77.9 t -53.2 -42.21 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.449 1.5 . . . . 0.0 112.491 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.4 -32.71 71.58 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.053 -1.03 . . . . 0.0 113.584 176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -25.9 65.27 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.829 0.74 . . . . 0.0 111.181 177.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -84.59 -38.08 20.36 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.368 1.867 . . . . 0.0 111.624 176.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.406 HD22 HD21 ' A' ' 30' ' ' LEU . 65.1 tp -59.5 -48.85 80.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.472 0.709 . . . . 0.0 111.388 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 35.7 mtt -59.25 -34.98 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -66.53 -39.24 88.52 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.321 1.048 . . . . 0.0 112.347 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -66.49 -49.02 67.97 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.994 0.816 . . . . 0.0 112.434 174.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.03 -29.76 71.07 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.526 -0.734 . . . . 0.0 112.366 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.08 -21.81 65.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 113.157 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.66 -20.4 50.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.482 1.513 . . . . 0.0 112.387 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -116.33 -0.7 12.51 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.222 1.809 . . . . 0.0 112.147 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.52 17.6 64.65 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.102 1.334 . . . . 0.0 115.049 -172.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.499 HG23 HG23 ' A' ' 46' ' ' THR . 34.4 mm -66.88 152.37 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 118.871 1.336 . . . . 0.0 109.641 169.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -143.9 153.88 57.92 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 125.046 1.338 . . . . 0.0 111.576 173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.4 157.91 57.94 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.952 2.435 . . . . 0.0 111.238 170.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.78 -26.75 67.11 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.069 -1.019 . . . . 0.0 112.853 -178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -62.94 -12.47 25.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.25 1.42 . . . . 0.0 114.489 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -89.03 3.61 51.09 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -142.43 80.82 1.72 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 112.181 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.99 179.75 7.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.059 1.744 . . . . 0.0 112.093 174.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -55.56 147.57 17.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.326 1.45 . . . . 0.0 114.545 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -50.95 44.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.2 mm 63.88 133.15 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 127.313 2.245 . . . . 0.0 113.606 -172.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.18 172.74 9.54 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 125.098 3.865 . . . . 0.0 113.748 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.53 -85.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.755 2.97 . . . . 0.0 113.459 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 158.83 162.11 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.516 2.727 . . . . 0.0 112.693 -175.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.0 Cg_endo -71.27 169.79 19.86 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.03 3.153 . . . . 0.0 113.749 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.87 2.25 39.36 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.484 1.513 . . . . 0.0 114.774 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.0 p90 -136.62 158.36 73.34 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 125.451 1.5 . . . . 0.0 111.489 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -70.86 159.43 52.6 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.71 2.274 . . . . 0.0 113.434 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.95 137.4 93.82 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.996 -0.44 . . . . 0.0 112.047 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -65.74 177.32 2.93 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.21 3.273 . . . . 0.0 112.825 175.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 11.8 p -136.23 152.03 74.47 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.799 1.24 . . . . 0.0 113.175 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.04 169.57 14.77 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 124.785 3.657 . . . . 0.0 113.717 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -71.68 78.71 1.65 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.723 3.616 . . . . 0.0 111.302 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.9 p -142.8 152.63 17.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 125.374 1.469 . . . . 0.0 110.587 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 3.7 pp0? -146.39 163.47 35.5 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.484 1.514 . . . . 0.0 111.542 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -66.86 108.51 2.57 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.877 0.871 . . . . 0.0 111.449 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.83 -13.17 62.24 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -112.78 158.86 19.59 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.723 1.609 . . . . 0.0 110.571 169.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.9 p -142.23 166.09 25.64 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.719 1.207 . . . . 0.0 112.367 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.38 147.28 49.16 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.504 1.121 . . . . 0.0 113.353 -178.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 C--O 1.252 1.197 0 C-N-CA 123.882 3.055 . . . . 0.0 113.091 177.86 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t 47.45 45.24 17.18 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 127.059 2.144 . . . . 0.0 116.038 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -123.76 36.28 4.66 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.755 1.622 . . . . 0.0 112.087 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -136.91 173.44 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.577 1.551 . . . . 0.0 113.274 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -118.05 -65.85 1.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.531 1.533 . . . . 0.0 112.706 -175.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -15.58 63.67 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 176.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.8 pt -142.0 -172.78 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 128.232 2.613 . . . . 0.0 108.946 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.64 -27.94 4.3 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.587 1.089 . . . . 0.0 111.568 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -58.85 -42.96 90.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.929 1.692 . . . . 0.0 113.594 171.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.73 133.48 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 123.91 0.884 . . . . 0.0 110.639 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.72 84.05 0.36 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.354 1.93 . . . . 0.0 109.238 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -129.67 148.3 51.54 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.348 1.459 . . . . 0.0 111.384 175.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.47 141.21 34.84 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 124.471 1.108 . . . . 0.0 113.773 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.82 2.54 4.02 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.852 3.702 . . . . 0.0 114.975 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -106.83 -33.41 7.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.851 1.261 . . . . 0.0 113.072 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 80.6 p -131.74 -28.05 1.84 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.487 1.115 . . . . 0.0 113.514 -169.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.28 -159.95 14.35 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.944 1.259 . . . . 0.0 114.54 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -64.08 147.23 52.66 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.947 175.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -95.59 79.45 3.38 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.072 0.949 . . . . 0.0 111.981 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.547 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.1 mm? -46.91 -41.19 15.55 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.806 1.242 . . . . 0.0 113.454 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -57.86 -25.95 61.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.337 1.455 . . . . 0.0 114.472 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -133.44 19.13 3.96 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.447 1.099 . . . . 0.0 113.416 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.36 149.35 38.51 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 122.149 0.976 . . . . 0.0 112.765 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.28 159.49 57.64 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 125.504 1.521 . . . . 0.0 113.532 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.01 -12.59 36.05 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 124.214 3.276 . . . . 0.0 114.184 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -119.54 -11.47 9.46 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.553 1.141 . . . . 0.0 112.767 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -73.49 -69.37 0.43 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.08 0.952 . . . . 0.0 111.13 -177.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -32.45 63.01 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.61 -48.45 66.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.877 0.871 . . . . 0.0 111.051 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.697 HD11 HD22 ' C' ' 140' ' ' LEU . 0.8 OUTLIER -60.65 -43.44 97.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.318 1.447 . . . . 0.0 111.682 169.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.7 m-85 -59.1 -44.8 91.99 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.357 0.526 . . . . 0.0 110.511 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -70.44 -24.6 62.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.046 0.938 . . . . 0.0 113.367 176.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 11.1 tpp -68.65 -55.71 10.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.2 1.0 . . . . 0.0 111.139 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 15.0 t -68.96 -34.86 76.02 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.327 0.651 . . . . 0.0 111.381 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.27 8.06 6.7 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.618 1.104 . . . . 0.0 114.903 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -63.33 142.31 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 125.317 1.447 . . . . 0.0 109.908 175.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 t -111.98 159.69 18.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.697 0.799 . . . . 0.0 111.865 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.22 -25.9 49.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.764 1.226 . . . . 0.0 113.498 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.87 95.25 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 170.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -69.61 -36.91 76.62 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.242 0.617 . . . . 0.0 111.117 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.5 mp -61.86 -26.15 67.97 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.816 1.647 . . . . 0.0 113.111 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 mmmt -99.32 3.51 46.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.857 1.263 . . . . 0.0 113.144 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.97 115.09 27.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.644 1.177 . . . . 0.0 109.544 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.428 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -61.6 -14.34 29.68 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.854 -1.154 . . . . 0.0 113.806 179.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -101.71 -18.35 15.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.659 1.584 . . . . 0.0 112.381 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.676 HG23 HG23 ' C' ' 149' ' ' ILE . 23.0 m -109.03 -51.33 2.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.148 0.979 . . . . 0.0 111.508 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.2 p -55.32 -35.75 65.49 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.788 1.235 . . . . 0.0 112.872 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.8 tptm -52.39 -49.52 64.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.766 1.226 . . . . 0.0 113.158 171.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.43 -41.9 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.9 mt -61.59 -40.96 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 O-C-N 122.116 -0.365 . . . . 0.0 110.31 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -64.87 -43.27 93.5 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.243 1.017 . . . . 0.0 112.878 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -54.4 -33.72 59.88 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.475 0.71 . . . . 0.0 112.711 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -66.5 -46.46 76.17 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.271 0.628 . . . . 0.0 111.903 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 mt -65.59 -38.62 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 120.52 -1.362 . . . . 0.0 110.753 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.31 -13.0 61.58 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.53 -13.43 7.55 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -175.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.6 m -149.84 -29.52 0.23 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.699 1.2 . . . . 0.0 113.43 -170.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -73.65 -106.46 0.07 OUTLIER Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.339 -1.256 . . . . 0.0 110.883 170.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.04 125.82 0.02 OUTLIER Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.488 1.995 . . . . 0.0 114.22 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.1 p -56.53 -33.72 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 O-C-N 121.352 -1.087 . . . . 0.0 113.785 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -84.89 -30.02 24.74 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.24 -46.2 67.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.03 1.332 . . . . 0.0 112.861 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.07 -28.5 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.33 1.052 . . . . 0.0 111.814 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.05 -8.1 46.6 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.831 2.052 . . . . 0.0 115.102 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 m120 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.697 1.999 . . . . 0.0 113.545 -175.076 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 44.1 m -80.28 -34.5 36.88 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -88.91 149.91 23.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.481 1.112 . . . . 0.0 111.723 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 44.2 mtp 61.45 110.39 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.62 2.368 . . . . 0.0 113.566 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -94.52 44.01 1.1 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.222 1.809 . . . . 0.0 112.497 -172.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -135.92 160.02 39.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.808 2.043 . . . . 0.0 110.621 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -59.21 142.89 50.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.451 0.7 . . . . 0.0 110.691 175.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . 0.502 ' HG2' HG23 ' B' ' 98' ' ' THR . 33.4 mtmt -126.76 159.7 33.01 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.608 0.763 . . . . 0.0 111.493 176.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.74 147.18 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.883 1.273 . . . . 0.0 110.735 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -94.54 124.17 38.4 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 167.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 27.3 p -69.16 138.62 54.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 168.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -113.55 -1.76 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.881 1.272 . . . . 0.0 111.719 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -153.25 156.84 32.84 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 126.247 1.819 . . . . 0.0 111.059 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -72.19 163.09 39.77 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.646 2.897 . . . . 0.0 113.056 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -145.3 153.96 41.83 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.493 1.517 . . . . 0.0 111.039 174.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 15.4 t -127.25 133.85 50.15 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.857 1.263 . . . . 0.0 112.084 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.74 -14.37 58.78 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.438 1.095 . . . . 0.0 113.63 176.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 55.7 -108.54 1.1 Allowed Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.237 0.923 . . . . 0.0 112.566 -170.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 45.8 m -110.71 0.98 17.62 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.22 1.408 . . . . 0.0 114.039 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -82.46 161.16 22.51 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.02 0.928 . . . . 0.0 112.711 -176.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -118.05 8.23 12.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.885 1.674 . . . . 0.0 113.171 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -120.86 13.06 11.41 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.299 1.84 . . . . 0.0 112.083 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 26.7 mt -111.85 157.92 20.03 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.786 1.234 . . . . 0.0 112.157 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -119.69 124.61 46.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 0.0 109.868 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 53.4 p -111.21 150.08 30.06 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.094 1.357 . . . . 0.0 111.688 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -166.71 -178.47 4.35 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.576 1.55 . . . . 0.0 111.605 -170.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -123.27 165.02 17.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.535 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -53.69 136.4 39.5 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.877 -1.139 . . . . 0.0 111.558 174.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.01 -4.7 75.14 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.337 0.97 . . . . 0.0 113.803 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -79.45 157.45 27.51 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.27 1.035 . . . . 0.0 112.129 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -121.07 134.37 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.427 1.491 . . . . 0.0 111.098 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -130.86 139.0 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.531 1.532 . . . . 0.0 109.646 -174.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . 0.502 HG23 ' HG2' ' B' ' 73' ' ' LYS . 3.3 m -103.36 115.54 30.73 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.932 1.293 . . . . 0.0 109.239 178.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.83 144.88 56.7 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.413 1.006 . . . . 0.0 111.007 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.4 mt -120.92 0.15 10.21 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.996 1.318 . . . . 0.0 112.693 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.9 pt -124.99 153.29 71.19 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.673 1.589 . . . . 0.0 110.619 -174.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.47 -25.81 12.67 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.373 2.715 . . . . 0.0 114.674 -175.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -155.7 162.25 40.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.28 1.432 . . . . 0.0 112.252 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.3 166.39 22.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.78 122.17 12.37 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.885 0.874 . . . . 0.0 111.507 174.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 53.28 23.7 3.36 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.05 -4.91 78.91 Favored Glycine 0 CA--C 1.542 1.757 0 C-N-CA 125.72 1.629 . . . . 0.0 115.833 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.459 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.8 m95 -87.75 133.68 33.81 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.684 1.994 . . . . 0.0 111.647 173.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.459 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -119.95 150.45 40.49 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.503 1.921 . . . . 0.0 109.047 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -118.92 133.62 55.71 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.739 0.78 . . . . 0.0 110.144 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.29 -174.87 35.39 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.838 -173.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -132.74 119.32 20.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.421 1.888 . . . . 0.0 110.3 -168.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.442 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.7 t-80 -67.9 130.42 42.92 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.235 1.014 . . . . 0.0 113.388 -174.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.8 12.29 1.78 Allowed 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.442 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.7 m -128.73 -23.61 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 124.988 1.315 . . . . 0.0 113.817 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.1 t -127.01 -13.86 5.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.09 1.756 . . . . 0.0 112.553 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 59.83 9.78 1.83 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.025 2.13 . . . . 0.0 113.857 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.27 144.66 55.8 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.015 1.726 . . . . 0.0 110.989 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt85 -122.33 151.22 41.38 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.035 1.334 . . . . 0.0 111.05 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.39 165.43 26.76 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 124.028 0.823 . . . . 0.0 111.747 -178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -71.77 133.52 45.61 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -131.28 153.87 81.79 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.946 1.298 . . . . 0.0 112.121 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.0 118.47 5.64 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.935 3.09 . . . . 0.0 113.051 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.403 ' HB2' HD23 ' B' ' 109' ' ' LEU . 1.7 t -60.28 -28.89 68.44 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 121.501 -0.749 . . . . 0.0 112.833 170.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -29.56 69.93 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.064 -1.022 . . . . 0.0 113.409 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.7 m-30 -88.02 9.86 20.99 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.92 1.288 . . . . 0.0 113.86 173.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.0 p -133.94 173.18 11.84 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.344 -1.473 . . . . 0.0 111.713 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -133.24 -88.89 0.41 Allowed 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.5 -0.75 . . . . 0.0 111.844 174.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 3.1 pp -166.76 174.3 8.77 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.163 1.785 . . . . 0.0 111.506 -174.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.9 mt -132.92 17.9 4.17 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.7 1.6 . . . . 0.0 112.862 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -63.48 119.78 10.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.055 0.942 . . . . 0.0 111.425 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 125.285 1.434 . . . . 0.0 112.85 178.033 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.328 -1.32 . . . . 0.0 113.343 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 -34.45 16.94 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.116 1.877 . . . . 0.0 113.649 -163.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -70.15 -38.14 75.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.967 -0.458 . . . . 0.0 111.546 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -61.75 -33.3 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 O-C-N 121.017 -1.052 . . . . 0.0 111.896 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.01 72.89 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.413 -1.429 . . . . 0.0 113.192 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -27.11 68.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.066 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 3.3 ptp85 -99.62 -24.28 14.78 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.501 1.92 . . . . 0.0 112.9 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 30' ' ' LEU . 56.7 tp -63.25 -48.18 79.3 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.84 0.746 . . . . 0.0 111.899 171.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 70.4 mtm -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -67.04 -38.44 85.87 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.489 1.116 . . . . 0.0 112.323 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -68.35 -49.15 62.28 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.211 1.005 . . . . 0.0 112.414 174.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.55 -23.33 66.2 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.08 -19.72 61.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.693 1.197 . . . . 0.0 113.201 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -82.1 -19.99 39.02 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.836 1.254 . . . . 0.0 112.585 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -117.13 1.76 12.56 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.95 1.7 . . . . 0.0 112.216 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 59.89 39.6 95.72 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.013 1.292 . . . . 0.0 114.643 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.676 HG23 HG23 ' A' ' 46' ' ' THR . 9.2 mm -75.94 -68.08 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 122.087 0.946 . . . . 0.0 112.247 176.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 52.76 156.85 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 129.461 3.104 . . . . 0.0 115.192 -169.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -66.02 165.29 24.42 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.936 2.424 . . . . 0.0 112.817 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.87 -16.97 62.15 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.818 -1.176 . . . . 0.0 112.981 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -63.75 -12.48 35.42 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.903 1.281 . . . . 0.0 114.304 162.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -107.76 64.37 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.171 1.389 . . . . 0.0 111.135 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.1 mmt -130.42 -176.34 3.93 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.188 2.195 . . . . 0.0 110.309 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.55 123.18 16.02 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.348 -0.845 . . . . 0.0 112.179 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -143.56 -55.1 0.38 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.842 1.257 . . . . 0.0 112.471 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.26 176.75 1.99 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.688 1.995 . . . . 0.0 110.49 -171.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.1 mm -113.2 134.24 21.91 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 124.38 1.072 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -66.29 174.27 6.35 Favored 'Trans proline' 0 CA--C 1.549 1.248 1 C-N-CA 125.984 4.456 . . . . 0.0 114.196 178.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.98 -85.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.853 3.036 . . . . 0.0 113.15 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 160.4 162.71 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 128.334 2.654 . . . . 0.0 112.608 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.39 170.32 18.69 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 123.878 3.052 . . . . 0.0 113.48 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -86.28 4.76 37.59 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.007 1.323 . . . . 0.0 114.474 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -137.3 158.79 71.69 Favored Pre-proline 0 N--CA 1.473 0.715 0 C-N-CA 125.457 1.503 . . . . 0.0 111.625 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.18 157.82 56.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.71 2.273 . . . . 0.0 113.884 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.9 133.41 95.57 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.7 168.46 20.0 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.847 3.031 . . . . 0.0 113.579 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 25.0 p -128.43 150.45 74.4 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.419 1.488 . . . . 0.0 112.881 -171.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.11 169.69 16.08 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.854 3.703 . . . . 0.0 113.346 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.39 78.69 1.54 Allowed 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.784 3.656 . . . . 0.0 111.467 174.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.6 p -144.05 148.12 18.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.265 1.426 . . . . 0.0 110.542 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.39 155.19 42.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.055 1.342 . . . . 0.0 111.149 174.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -151.13 -33.4 0.15 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -74.14 119.09 17.87 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.437 -0.789 . . . . 0.0 109.864 167.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -60.21 142.09 54.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 12.4 t -159.53 156.27 27.86 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.502 1.521 . . . . 0.0 110.806 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 32.1 mtm-85 60.2 158.41 0.11 Allowed Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 127.947 2.499 . . . . 0.0 115.072 -174.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 C--O 1.254 1.277 0 C-N-CA 123.663 2.909 . . . . 0.0 113.211 -179.72 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -125.83 -5.18 6.92 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -76.91 163.92 26.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.081 0.952 . . . . 0.0 112.546 174.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -146.72 173.82 12.01 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.365 1.466 . . . . 0.0 112.906 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -114.79 -68.48 0.92 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.602 1.561 . . . . 0.0 112.149 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -14.89 63.1 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 12.2 pt -141.34 -174.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.565 2.346 . . . . 0.0 109.535 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.15 -25.13 4.39 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.541 1.067 . . . . 0.0 111.94 171.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -64.01 -34.98 79.24 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.568 1.947 . . . . 0.0 114.493 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.26 158.43 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.424 1.09 . . . . 0.0 111.519 -177.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.65 30.34 4.47 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.121 1.343 . . . . 0.0 114.054 -175.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -83.84 151.06 25.35 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.187 0.994 . . . . 0.0 112.639 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -137.7 144.1 43.16 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 171.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.8 -1.04 7.83 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 125.052 3.835 . . . . 0.0 115.393 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -109.2 -23.32 11.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.899 1.28 . . . . 0.0 113.591 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.0 p -134.45 -46.29 0.76 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.413 1.085 . . . . 0.0 112.07 -171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.92 -158.5 18.5 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.155 1.836 . . . . 0.0 113.306 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -62.28 146.9 49.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.018 0.927 . . . . 0.0 111.268 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -91.5 77.62 5.72 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.513 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.5 mm? -47.35 -43.51 23.08 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.666 1.186 . . . . 0.0 113.766 -176.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -60.68 -18.6 54.92 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.49 1.516 . . . . 0.0 114.469 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -138.24 20.77 2.78 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.77 1.628 . . . . 0.0 112.679 -177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 27' ' ' LEU . 7.3 mt -62.58 151.52 37.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.271 1.034 . . . . 0.0 112.154 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.24 158.05 59.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 125.403 1.481 . . . . 0.0 112.723 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.42 -10.96 28.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.85 3.033 . . . . 0.0 113.816 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -110.23 -24.52 10.64 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.489 1.515 . . . . 0.0 112.401 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -72.66 -64.89 0.87 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.463 0.649 . . . . 0.0 111.231 -166.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.73 -30.2 63.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.085 0.954 . . . . 0.0 112.863 173.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -67.19 -45.11 77.91 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.463 1.105 . . . . 0.0 110.574 -176.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.464 HD21 HD22 ' C' ' 140' ' ' LEU . 26.0 tp -63.52 -44.78 93.28 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 124.339 1.056 . . . . 0.0 112.186 168.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.6 m-30 -57.4 -44.11 84.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 118.682 0.674 . . . . 0.0 110.94 -177.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -69.84 -19.59 63.45 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.313 1.045 . . . . 0.0 113.403 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.9 tpp -81.75 -58.29 3.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.783 1.233 . . . . 0.0 111.75 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HB3' HD12 ' A' ' 36' ' ' ILE . 44.4 t -66.5 -29.18 69.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.039 0.836 . . . . 0.0 112.008 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.53 6.26 11.87 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.444 1.021 . . . . 0.0 114.458 175.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.459 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -61.92 145.51 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 124.195 0.998 . . . . 0.0 110.528 173.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -118.09 161.15 20.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.139 0.976 . . . . 0.0 111.855 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -56.05 -26.38 48.89 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.924 1.29 . . . . 0.0 113.754 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.93 -44.19 97.58 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 171.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -67.0 -37.57 84.45 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.288 0.635 . . . . 0.0 110.74 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD21 ' CD2' ' A' ' 31' ' ' PHE . 2.3 mp -64.86 -25.98 68.13 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 125.721 1.609 . . . . 0.0 113.123 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -99.62 6.08 45.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.921 1.288 . . . . 0.0 112.948 174.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.425 ' HB3' ' HB ' ' A' ' 46' ' ' THR . 13.4 t70 -93.01 110.76 22.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.513 1.525 . . . . 0.0 109.567 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.497 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -61.27 -14.51 26.85 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 120.799 -1.188 . . . . 0.0 114.199 -177.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -99.56 -19.21 16.99 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.317 1.447 . . . . 0.0 112.651 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.622 HG23 HG23 ' C' ' 149' ' ' ILE . 26.6 m -109.86 -51.16 2.9 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.733 1.213 . . . . 0.0 111.19 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.7 p -53.58 -35.72 61.13 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.924 1.29 . . . . 0.0 112.593 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -53.07 -50.27 64.71 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.592 1.157 . . . . 0.0 113.043 170.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.64 -42.69 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.745 0.818 . . . . 0.0 110.75 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.6 mt -62.19 -39.74 85.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 O-C-N 122.107 -0.371 . . . . 0.0 110.482 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.86 -44.44 85.4 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.981 -1.074 . . . . 0.0 112.702 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -54.37 -32.65 57.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.226 0.61 . . . . 0.0 112.622 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -67.02 -46.49 74.31 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.62 0.768 . . . . 0.0 112.335 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.6 mt -63.67 -37.32 79.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 120.3 -1.5 . . . . 0.0 110.692 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.07 -14.47 48.63 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 175.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -130.3 -10.19 4.17 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -171.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.0 m -152.65 -28.47 0.15 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.806 1.242 . . . . 0.0 113.151 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.55 -115.85 0.17 Allowed Glycine 0 CA--C 1.527 0.785 0 CA-C-O 118.443 -1.198 . . . . 0.0 110.574 165.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.53 124.84 0.04 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 126.672 2.082 . . . . 0.0 113.898 -169.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -56.71 -35.16 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 O-C-N 121.073 -1.251 . . . . 0.0 114.14 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.0 -30.13 22.95 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.046 0.938 . . . . 0.0 113.293 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.47 -38.16 83.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.233 1.413 . . . . 0.0 113.205 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.0 t -72.96 -29.02 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.548 0.739 . . . . 0.0 111.795 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -34.45 77.2 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 171.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.17 1.388 . . . . 0.0 113.146 -176.829 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.535 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 58.6 p -144.26 136.57 26.54 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.465 1.106 . . . . 0.0 112.139 175.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -87.21 -16.56 34.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.625 1.17 . . . . 0.0 113.325 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.0 mtp -139.35 179.2 6.68 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.006 1.722 . . . . 0.0 111.492 -174.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.73 13.27 6.9 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.761 1.625 . . . . 0.0 113.222 -177.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.44 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.5 mmpt? -95.99 165.49 12.23 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.78 1.632 . . . . 0.0 111.204 173.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -60.67 150.1 33.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.158 0.983 . . . . 0.0 111.809 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -124.84 164.67 19.52 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.064 0.945 . . . . 0.0 112.084 170.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 m -134.6 151.44 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.866 1.666 . . . . 0.0 109.915 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -99.9 122.89 43.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 166.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 25.8 p -68.62 130.43 42.82 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -107.19 -1.33 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.601 1.161 . . . . 0.0 111.722 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -154.27 157.58 32.33 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.614 1.966 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.57 162.87 40.85 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.417 2.745 . . . . 0.0 113.19 176.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -144.89 153.3 41.43 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.309 1.444 . . . . 0.0 110.779 170.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 51.5 m -139.32 112.88 8.36 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.314 1.446 . . . . 0.0 110.226 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.14 69.23 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.71 -124.98 34.18 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.094 -1.004 . . . . 0.0 112.458 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.7 m -90.22 14.31 12.96 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -169.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -111.98 160.27 17.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.689 1.196 . . . . 0.0 113.202 -175.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -122.81 9.72 9.5 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.129 1.772 . . . . 0.0 113.856 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -116.2 8.14 14.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.334 1.854 . . . . 0.0 112.162 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 30.5 mt -104.79 163.36 12.57 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.275 1.43 . . . . 0.0 112.796 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 49.5 tp -123.98 127.64 48.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.784 1.634 . . . . 0.0 110.184 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 43.2 m -113.07 146.13 39.69 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.823 1.249 . . . . 0.0 111.36 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -163.11 -178.27 5.92 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.292 1.437 . . . . 0.0 112.363 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.37 165.1 16.82 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.175 1.79 . . . . 0.0 111.773 174.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -54.86 137.92 44.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.912 -1.117 . . . . 0.0 111.647 174.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.85 -4.29 75.12 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.443 1.02 . . . . 0.0 113.653 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -80.69 156.89 26.09 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.029 0.931 . . . . 0.0 111.691 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 78.4 t -122.86 134.81 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.362 1.465 . . . . 0.0 110.611 -171.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.9 mm -127.95 135.73 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.232 1.413 . . . . 0.0 109.154 -177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.2 m -98.72 124.57 43.64 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.079 0.952 . . . . 0.0 109.559 175.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.34 144.17 54.89 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.352 0.661 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -119.88 0.35 10.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.213 1.405 . . . . 0.0 112.59 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -127.17 154.12 76.8 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.964 1.706 . . . . 0.0 110.516 -175.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.31 -26.03 10.82 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.397 2.732 . . . . 0.0 114.828 -175.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -156.26 162.35 40.15 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.251 1.42 . . . . 0.0 112.08 -175.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -72.63 167.22 21.2 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 121.67 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.132 174.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.7 t0 52.2 24.17 2.67 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.304 -1.497 . . . . 0.0 114.839 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.64 -4.73 81.18 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.549 1.547 . . . . 0.0 115.915 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.49 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.7 m95 -88.02 133.79 33.88 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.426 1.891 . . . . 0.0 111.982 172.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.49 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.61 152.9 38.78 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.831 2.052 . . . . 0.0 109.485 176.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -123.95 134.27 53.53 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.939 0.876 . . . . 0.0 110.804 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.62 -178.1 36.18 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.714 -171.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -123.09 130.3 52.6 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.781 1.632 . . . . 0.0 109.727 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -69.23 132.12 45.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.155 0.982 . . . . 0.0 112.671 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -72.67 5.66 2.97 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.31 -19.26 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.9 t -138.18 -15.74 1.27 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.452 1.501 . . . . 0.0 112.835 -171.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp 62.65 16.95 9.32 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.35 1.86 . . . . 0.0 113.811 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 137.5 57.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.313 1.045 . . . . 0.0 110.701 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -122.14 150.47 42.15 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.683 1.593 . . . . 0.0 110.997 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.25 166.64 26.67 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 123.958 0.79 . . . . 0.0 112.211 -177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.99 130.75 41.73 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 171.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -125.42 152.6 71.72 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 124.628 1.171 . . . . 0.0 111.905 174.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.11 117.78 5.31 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.374 2.716 . . . . 0.0 112.382 176.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.44 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.7 OUTLIER -57.25 -36.77 71.38 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.612 -0.68 . . . . 0.0 112.493 174.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 22.4 m -62.28 -27.55 69.1 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -82.36 10.27 7.39 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.546 1.138 . . . . 0.0 113.564 169.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 9.6 p -137.13 166.78 22.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.419 1.488 . . . . 0.0 112.155 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -141.05 151.36 43.98 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.906 1.282 . . . . 0.0 110.437 170.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -64.17 158.95 21.66 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.212 1.006 . . . . 0.0 113.051 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.24 23.85 12.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.36 1.864 . . . . 0.0 111.533 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.08 -30.39 70.31 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 166.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.749 1.619 . . . . 0.0 115.136 -179.133 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 mp . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 117.356 -1.307 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -68.12 -34.69 21.72 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 121.798 1.665 . . . . 0.0 113.786 -161.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.06 -32.01 68.58 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 92.5 t -65.09 -35.83 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-N 119.116 0.871 . . . . 0.0 111.414 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.69 -31.92 72.9 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.619 -1.301 . . . . 0.0 113.747 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.31 -20.61 62.17 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.547 -0.72 . . . . 0.0 112.536 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -99.91 -26.42 14.01 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.995 2.118 . . . . 0.0 113.051 174.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.464 HD22 HD21 ' A' ' 30' ' ' LEU . 57.0 tp -62.86 -49.61 74.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.249 0.931 . . . . 0.0 111.734 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 47.4 mtm -59.66 -31.64 69.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -67.0 -40.12 87.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.02 0.928 . . . . 0.0 112.256 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -65.92 -49.08 69.25 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.793 0.837 . . . . 0.0 112.525 174.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.42 -23.62 65.56 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.425 -0.797 . . . . 0.0 112.786 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.55 60.72 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.627 1.171 . . . . 0.0 113.063 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.41 -21.37 53.19 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.212 1.405 . . . . 0.0 112.4 -177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -117.17 2.44 12.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.022 1.729 . . . . 0.0 112.009 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.36 23.05 68.04 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.574 1.559 . . . . 0.0 115.114 -178.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.622 HG23 HG23 ' A' ' 46' ' ' THR . 7.5 mm -61.84 -62.81 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.586 1.154 . . . . 0.0 112.626 -177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 55.56 157.21 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 129.133 2.973 . . . . 0.0 114.191 -173.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.83 160.87 47.91 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.241 1.96 . . . . 0.0 112.005 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.23 -23.61 66.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -179.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -59.92 -5.02 0.85 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.371 1.868 . . . . 0.0 115.084 166.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -129.6 39.65 3.69 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.936 1.695 . . . . 0.0 112.328 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 29.1 mtm -130.36 92.93 3.36 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.256 1.423 . . . . 0.0 111.537 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.31 168.94 25.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.001 1.32 . . . . 0.0 112.421 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -140.65 165.43 27.5 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.126 1.37 . . . . 0.0 112.619 -176.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -76.07 174.89 9.47 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.623 1.969 . . . . 0.0 112.665 169.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.8 mm -122.09 134.93 24.96 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 125.145 1.378 . . . . 0.0 109.969 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -67.18 173.39 8.58 Favored 'Trans proline' 0 CA--C 1.55 1.278 1 C-N-CA 125.76 4.307 . . . . 0.0 114.131 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.28 -77.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.659 2.906 . . . . 0.0 113.967 178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.18 163.2 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 129.139 2.976 . . . . 0.0 112.838 -173.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 92.0 Cg_endo -71.78 172.18 14.99 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.252 3.301 . . . . 0.0 113.681 172.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.6 -1.6 57.29 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.209 1.403 . . . . 0.0 114.467 -178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -134.73 159.61 71.53 Favored Pre-proline 0 N--CA 1.474 0.774 0 C-N-CA 125.863 1.665 . . . . 0.0 111.543 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.03 158.52 52.24 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 122.894 2.396 . . . . 0.0 114.061 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.99 133.82 95.54 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.43 165.82 27.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.836 3.024 . . . . 0.0 113.084 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 17.7 p -128.09 153.05 78.5 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.701 1.6 . . . . 0.0 112.823 -170.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.48 169.71 15.11 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.542 3.495 . . . . 0.0 113.659 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 79.94 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.733 3.622 . . . . 0.0 111.523 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.0 p -143.77 148.85 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.538 1.535 . . . . 0.0 110.269 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -142.8 -47.06 0.32 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.2 1.0 . . . . 0.0 112.491 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -74.17 90.61 2.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.269 1.028 . . . . 0.0 111.132 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.31 68.37 0.75 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.806 1.642 . . . . 0.0 112.024 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -57.68 158.93 5.6 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.2 1.4 . . . . 0.0 112.474 173.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 30.4 t -136.71 142.97 43.12 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.95 1.3 . . . . 0.0 110.505 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 47.2 ptt85 -57.87 154.84 25.8 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.943 1.297 . . . . 0.0 112.737 173.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 C--O 1.255 1.332 0 C-N-CA 123.468 2.778 . . . . 0.0 112.838 169.29 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.519 -0.6 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 m -66.18 -27.97 68.41 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -109.49 172.0 7.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.746 1.618 . . . . 0.0 111.229 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -58.89 164.87 2.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -111.98 -65.76 1.15 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.306 1.443 . . . . 0.0 112.342 -173.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -16.21 63.27 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 176.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.7 pt -141.7 -171.86 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 127.701 2.401 . . . . 0.0 109.068 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.05 -28.23 7.39 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.159 0.885 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -58.86 -33.77 70.85 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.209 1.804 . . . . 0.0 114.06 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 p -69.95 -21.28 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -164.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.37 56.3 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.994 1.759 . . . . 0.0 117.123 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -77.64 148.58 34.98 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.566 1.183 . . . . 0.0 112.078 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -137.72 145.46 48.78 Favored Pre-proline 0 CA--C 1.547 0.858 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 171.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.99 3.18 3.03 Favored 'Trans proline' 0 C--N 1.354 0.825 1 C-N-CA 125.578 4.185 . . . . 0.0 115.759 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -120.46 -28.23 5.02 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.924 1.29 . . . . 0.0 113.464 178.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 55.7 p -127.5 -22.06 3.71 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -171.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.39 -167.9 23.85 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.598 1.094 . . . . 0.0 114.994 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -58.78 143.24 47.82 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.957 1.303 . . . . 0.0 111.848 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -79.4 68.21 5.35 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -42.8 -43.09 3.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.062 1.345 . . . . 0.0 114.595 -175.164 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -55.65 -29.66 59.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.313 1.445 . . . . 0.0 114.463 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -138.81 21.7 2.67 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.95 1.3 . . . . 0.0 113.873 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -53.29 150.8 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.191 1.396 . . . . 0.0 113.204 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.09 156.78 66.33 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 124.63 1.172 . . . . 0.0 113.335 -177.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.07 -12.57 35.99 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.198 3.265 . . . . 0.0 114.145 -177.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -106.61 -26.65 11.27 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.889 1.275 . . . . 0.0 112.542 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -70.05 -66.26 0.62 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.222 1.009 . . . . 0.0 111.154 -164.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -30.51 60.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.815 173.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' C' ' 133' ' ' LEU . 1.9 m-20 -69.53 -41.47 75.95 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.753 0.821 . . . . 0.0 111.016 -176.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.701 HD21 HD22 ' C' ' 140' ' ' LEU . 15.6 tp -65.36 -46.15 81.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.264 1.026 . . . . 0.0 111.887 167.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.494 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.5 m-30 -56.44 -44.99 80.99 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.931 0.787 . . . . 0.0 110.865 -176.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.74 -19.65 64.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.257 1.023 . . . . 0.0 113.311 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.2 ttp -86.69 -57.01 3.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.187 1.395 . . . . 0.0 112.777 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.06 -27.11 68.56 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.384 0.993 . . . . 0.0 111.462 176.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.58 4.38 13.41 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.959 1.266 . . . . 0.0 114.08 169.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.95 147.46 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.43 1.492 . . . . 0.0 110.655 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.4 t -122.7 165.47 16.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.861 0.865 . . . . 0.0 112.102 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.62 -26.78 45.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.91 1.284 . . . . 0.0 113.45 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.69 -44.47 93.63 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.484 -0.76 . . . . 0.0 113.044 172.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -71.4 -37.43 71.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.31 0.644 . . . . 0.0 110.928 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.6 mp -64.74 -26.33 68.31 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 125.883 1.673 . . . . 0.0 113.327 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -92.01 -5.89 52.14 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.366 1.466 . . . . 0.0 113.179 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -84.33 114.04 21.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.304 1.042 . . . . 0.0 109.571 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.477 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -60.13 -16.38 31.8 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.062 -1.024 . . . . 0.0 113.648 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.6 -34.81 11.29 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.921 1.288 . . . . 0.0 112.227 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.523 HG23 HG23 ' C' ' 149' ' ' ILE . 13.7 m -89.96 -53.72 4.36 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 118.772 0.715 . . . . 0.0 111.549 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -54.68 -36.64 64.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.675 1.19 . . . . 0.0 113.014 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 tptp -53.57 -50.01 66.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.469 1.107 . . . . 0.0 113.109 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.63 -45.21 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.968 0.907 . . . . 0.0 111.072 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.4 mt -60.9 -41.07 87.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -65.25 -43.66 90.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.821 1.248 . . . . 0.0 113.391 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.34 -34.42 57.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.758 0.708 . . . . 0.0 112.736 175.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.56 -48.74 71.38 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.252 0.621 . . . . 0.0 111.219 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.7 mt -62.63 -39.65 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.779 -1.201 . . . . 0.0 111.459 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -18.07 64.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.573 0.749 . . . . 0.0 112.972 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -121.35 -14.96 8.2 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -173.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.6 m -148.67 -26.42 0.31 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.166 1.387 . . . . 0.0 113.251 -168.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.551 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.88 -109.23 0.14 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 164.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.64 124.75 0.04 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.263 1.887 . . . . 0.0 113.21 -173.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.03 -32.86 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -88.18 -28.38 21.24 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.803 1.241 . . . . 0.0 113.81 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.46 -44.0 79.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.917 1.287 . . . . 0.0 112.947 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.5 t -66.67 -25.23 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.323 1.049 . . . . 0.0 112.374 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.77 -16.74 64.47 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 172.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 51.0 t30 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 126.102 1.761 . . . . 0.0 113.775 -167.886 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 CA-C-O 121.255 0.364 . . . . 0.0 112.231 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 74.5 p -137.09 54.72 1.85 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.815 1.646 . . . . 0.0 111.068 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -140.49 176.42 8.79 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.53 1.932 . . . . 0.0 112.114 -172.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 33.4 mtt 59.57 -171.9 0.12 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.977 1.711 . . . . 0.0 113.954 -177.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -124.67 162.25 24.55 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.797 1.639 . . . . 0.0 112.071 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.56 21.73 0.1 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.244 1.818 . . . . 0.0 115.41 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -138.18 131.58 30.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.018 1.327 . . . . 0.0 111.478 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -140.44 170.12 16.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.545 1.538 . . . . 0.0 111.271 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -133.35 153.41 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.652 1.581 . . . . 0.0 110.559 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.18 128.28 45.28 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 162.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 8.5 p -70.99 135.84 48.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.17 -3.37 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 O-C-N 120.667 -1.271 . . . . 0.0 111.947 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -153.91 157.07 32.53 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.155 1.782 . . . . 0.0 111.106 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.0 163.17 40.18 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.429 2.753 . . . . 0.0 113.044 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -143.51 138.36 29.14 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.887 1.275 . . . . 0.0 110.804 171.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -112.37 103.87 12.0 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.175 1.39 . . . . 0.0 109.958 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.17 67.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.198 1.399 . . . . 0.0 114.186 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 60.66 -140.63 48.04 Favored Glycine 0 CA--C 1.536 1.358 0 O-C-N 121.317 -0.864 . . . . 0.0 113.267 -176.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 17.2 m -73.68 -3.73 30.01 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -174.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -77.85 161.35 27.68 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -118.01 5.27 12.08 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 126.129 1.772 . . . . 0.0 113.284 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 28.8 p -124.39 13.18 8.82 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.639 1.976 . . . . 0.0 112.113 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -113.09 156.08 23.78 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.994 1.318 . . . . 0.0 112.34 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.6 tp -119.94 116.51 25.93 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.348 1.459 . . . . 0.0 110.275 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 11.9 p -102.9 146.25 28.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.064 1.346 . . . . 0.0 112.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -162.95 -179.12 6.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.466 1.506 . . . . 0.0 111.997 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -109.05 -177.53 3.33 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.507 1.523 . . . . 0.0 111.361 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -68.24 147.9 51.58 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.177 -0.952 . . . . 0.0 111.519 166.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.51 0.52 89.34 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 124.496 1.046 . . . . 0.0 113.739 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -80.3 169.0 18.36 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.129 1.372 . . . . 0.0 112.666 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 69.9 t -130.55 130.97 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.975 1.31 . . . . 0.0 110.529 -173.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 5.6 mm -128.19 136.53 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 124.907 1.283 . . . . 0.0 109.336 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 36.5 m -102.02 118.68 37.41 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.175 0.99 . . . . 0.0 109.469 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.95 138.87 57.59 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.485 0.714 . . . . 0.0 111.072 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.1 -6.73 14.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.566 1.546 . . . . 0.0 112.593 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.437 HG22 HG13 ' C' ' 159' ' ' ILE . 46.7 pt -119.27 152.88 53.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.998 1.719 . . . . 0.0 110.884 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.29 -25.28 11.57 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.497 2.798 . . . . 0.0 114.717 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -153.53 160.6 42.54 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.306 1.442 . . . . 0.0 112.125 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.98 167.38 21.61 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 177.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 121.23 10.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.294 174.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.55 24.67 4.26 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.512 -1.368 . . . . 0.0 114.366 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.15 -4.29 81.38 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.814 1.673 . . . . 0.0 115.721 -173.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.6 m95 -88.97 133.66 34.24 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.403 1.881 . . . . 0.0 111.888 174.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.467 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.3 mm? -120.8 150.33 41.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.623 1.969 . . . . 0.0 109.28 175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -119.03 136.62 54.03 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.864 0.84 . . . . 0.0 110.346 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -164.32 -177.61 37.14 Favored Glycine 0 CA--C 1.523 0.541 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.588 -171.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 60.9 tt0 -129.96 123.51 30.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.956 1.702 . . . . 0.0 109.242 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.414 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.4 t-80 -69.88 128.04 34.97 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.284 1.034 . . . . 0.0 112.439 -176.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.77 7.53 2.45 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -175.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -124.58 -18.24 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 124.891 1.277 . . . . 0.0 114.234 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 46.4 t -135.56 -19.02 1.65 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.996 1.719 . . . . 0.0 112.375 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 6.5 mmmm 65.2 13.78 8.97 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.893 2.077 . . . . 0.0 113.251 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.93 141.54 57.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.505 1.522 . . . . 0.0 110.988 170.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.6 mtt85 -123.08 148.06 46.05 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.938 1.695 . . . . 0.0 110.588 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.39 166.36 27.32 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 123.936 0.779 . . . . 0.0 111.274 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.81 133.84 45.76 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -128.14 153.93 78.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.669 1.188 . . . . 0.0 111.662 173.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.68 115.91 4.49 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.419 2.746 . . . . 0.0 112.768 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.44 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.2 t -58.22 -29.31 65.61 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.1 m -56.48 -36.73 69.44 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.038 0.935 . . . . 0.0 113.461 178.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -87.36 8.49 24.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.468 1.507 . . . . 0.0 113.536 176.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 15.0 p -131.55 168.82 17.02 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.621 -1.299 . . . . 0.0 112.09 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -139.88 144.86 37.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.496 1.118 . . . . 0.0 110.39 169.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.71 148.63 28.7 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.042 0.937 . . . . 0.0 111.389 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 27.4 mt -108.02 17.52 22.28 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.324 1.45 . . . . 0.0 111.839 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 152.84 13.76 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.307 1.043 . . . . 0.0 113.321 167.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--O 1.256 1.406 0 C-N-CA 127.331 2.252 . . . . 0.0 115.066 -175.319 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 117.357 -1.306 . . . . 0.0 113.432 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.58 -35.76 16.39 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.054 1.836 . . . . 0.0 113.591 -165.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -71.27 -32.66 68.97 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 174.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 86.7 t -62.96 -35.04 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.77 0.828 . . . . 0.0 111.5 -177.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.83 71.11 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.4 -1.437 . . . . 0.0 114.137 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -71.64 -20.68 61.93 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.497 -0.752 . . . . 0.0 112.529 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -102.59 -23.51 13.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.267 2.227 . . . . 0.0 112.946 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.701 HD22 HD21 ' A' ' 30' ' ' LEU . 66.5 tp -63.24 -50.16 71.3 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.095 0.861 . . . . 0.0 111.295 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 36.1 mtm -61.43 -30.67 70.72 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -63.66 -42.49 98.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.764 1.226 . . . . 0.0 112.669 170.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -66.41 -49.32 67.18 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.046 0.839 . . . . 0.0 112.555 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.54 -29.85 70.87 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.628 -0.67 . . . . 0.0 112.347 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.78 -21.51 66.05 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.936 1.294 . . . . 0.0 113.261 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -79.57 -20.74 46.29 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.519 1.528 . . . . 0.0 112.455 -177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -115.89 -1.16 12.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.1 1.76 . . . . 0.0 112.304 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.71 17.65 65.12 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 125.073 1.32 . . . . 0.0 115.012 -172.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.523 HG23 HG23 ' A' ' 46' ' ' THR . 35.0 mm -65.71 154.56 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 118.937 1.368 . . . . 0.0 109.644 168.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.79 152.5 41.01 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.591 1.157 . . . . 0.0 111.516 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -67.39 157.48 61.56 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.775 2.317 . . . . 0.0 110.84 172.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.32 66.42 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.313 -0.867 . . . . 0.0 113.193 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ptm85 -69.82 -11.38 60.81 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 171.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 -109.6 30.73 6.38 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.771 1.628 . . . . 0.0 111.952 -175.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 36.8 mtt -102.29 119.99 39.74 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.899 1.28 . . . . 0.0 111.114 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.7 172.03 19.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.606 1.962 . . . . 0.0 110.907 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' C' ' 159' ' ' ILE . 1.1 pm0 -123.59 158.88 30.45 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.989 1.316 . . . . 0.0 112.564 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 -52.28 5.82 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . 0.454 HD11 ' HG3' ' C' ' 157' ' ' GLU . 13.4 mm 64.38 133.98 0.04 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 127.524 2.33 . . . . 0.0 113.638 -173.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.55 172.98 8.44 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 124.984 3.789 . . . . 0.0 113.536 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.64 -78.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.354 2.703 . . . . 0.0 113.877 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.36 162.45 0.0 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 129.244 3.018 . . . . 0.0 112.395 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 88.7 Cg_endo -71.14 169.06 21.53 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 124.044 3.163 . . . . 0.0 113.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -79.36 -9.56 59.62 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.6 p90 -126.41 158.54 66.79 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.485 1.514 . . . . 0.0 111.746 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.73 158.87 54.46 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.68 2.253 . . . . 0.0 113.455 178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.14 137.6 95.77 Favored Pre-proline 0 CA--C 1.55 0.964 0 O-C-N 121.962 -0.461 . . . . 0.0 111.893 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.98 178.88 2.12 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.322 3.348 . . . . 0.0 112.785 175.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 9.6 p -135.78 151.62 74.48 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 124.752 1.221 . . . . 0.0 113.097 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.11 167.37 20.23 Favored 'Trans proline' 0 CA--C 1.544 0.975 0 C-N-CA 124.624 3.549 . . . . 0.0 113.466 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.08 72.07 1.63 Allowed 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 124.984 3.789 . . . . 0.0 112.389 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 60.0 t -137.75 148.07 25.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 125.96 1.704 . . . . 0.0 108.85 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -123.95 104.1 8.71 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.824 1.25 . . . . 0.0 109.812 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -67.54 -21.15 65.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.707 1.203 . . . . 0.0 114.059 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -64.59 119.03 9.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.481 1.112 . . . . 0.0 111.046 173.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -59.61 151.81 23.78 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.704 0.764 . . . . 0.0 112.831 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 67.3 m -139.31 168.38 19.95 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.428 1.891 . . . . 0.0 111.254 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 11.7 tpp85 76.78 133.49 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 128.955 2.902 . . . . 0.0 111.896 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 C--O 1.252 1.21 0 C-N-CA 123.446 2.764 . . . . 0.0 113.148 175.559 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.466 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t -151.42 162.83 40.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.486 1.515 . . . . 0.0 111.385 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -139.0 161.64 36.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.916 1.686 . . . . 0.0 111.983 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -67.96 171.46 6.73 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.65 1.18 . . . . 0.0 114.096 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.67 -65.06 1.22 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.612 1.565 . . . . 0.0 112.883 -177.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.89 -16.33 64.03 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 177.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.9 pt -141.92 -171.24 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 128.176 2.59 . . . . 0.0 108.822 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.9 -25.95 6.01 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.427 1.013 . . . . 0.0 111.901 173.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -55.38 -48.91 73.59 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.767 1.627 . . . . 0.0 112.42 168.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.416 HG11 ' HE1' ' A' ' 51' ' ' TYR . 7.8 p -62.71 136.72 25.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 111.678 -178.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.78 82.92 0.32 Allowed Glycine 0 CA--C 1.521 0.422 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -129.43 150.02 50.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.821 0.849 . . . . 0.0 112.911 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -137.35 143.56 41.85 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.942 1.297 . . . . 0.0 114.411 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.87 2.9 3.68 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.171 3.914 . . . . 0.0 115.349 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -110.91 -25.71 9.7 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.036 1.334 . . . . 0.0 113.763 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 68.2 p -134.74 -30.87 1.07 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.46 1.104 . . . . 0.0 113.169 -171.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.51 -158.96 15.13 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.053 1.311 . . . . 0.0 113.917 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -63.68 147.95 50.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.812 0.845 . . . . 0.0 111.44 174.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -96.04 76.68 3.1 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.887 1.675 . . . . 0.0 111.917 -176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.515 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -49.19 -40.67 34.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.865 1.266 . . . . 0.0 114.12 -173.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -58.33 -22.04 51.67 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.342 1.457 . . . . 0.0 114.489 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -138.74 21.38 2.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.675 1.59 . . . . 0.0 112.735 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 23' ' ' LEU . 7.0 mt -61.66 150.54 36.15 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.309 1.052 . . . . 0.0 112.608 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.87 158.41 61.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 125.606 1.562 . . . . 0.0 113.399 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.28 -11.47 31.5 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.971 3.114 . . . . 0.0 114.051 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -108.6 -24.66 11.26 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.866 0.866 . . . . 0.0 113.081 176.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.54 -66.31 0.6 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.106 0.962 . . . . 0.0 110.865 -165.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -31.97 63.31 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.926 174.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -68.36 -45.32 73.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.312 0.645 . . . . 0.0 110.769 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.491 HD21 HD22 ' C' ' 140' ' ' LEU . 17.3 tp -61.84 -44.99 95.73 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.156 0.983 . . . . 0.0 111.726 169.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.531 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.4 m-85 -57.49 -43.64 84.31 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.703 0.683 . . . . 0.0 110.934 -177.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -71.99 -16.15 62.07 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 174.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 17.9 tpp -82.97 -59.04 2.61 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.013 1.325 . . . . 0.0 111.387 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.56 -21.86 62.65 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.666 0.667 . . . . 0.0 112.671 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.1 3.01 19.93 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.982 1.277 . . . . 0.0 114.772 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.496 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mt -62.57 147.96 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 125.404 1.482 . . . . 0.0 111.344 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 82.4 p -114.83 166.66 11.53 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -53.8 -27.61 30.28 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.518 1.127 . . . . 0.0 113.669 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.9 -48.52 73.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.316 0.962 . . . . 0.0 112.474 174.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.22 -36.6 84.65 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.275 0.63 . . . . 0.0 111.033 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.531 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -64.75 -25.93 68.14 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.77 1.628 . . . . 0.0 113.418 175.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -98.55 3.48 48.07 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.966 1.307 . . . . 0.0 112.955 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -90.79 111.31 22.65 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.17 1.388 . . . . 0.0 109.217 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -61.1 -13.32 16.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 120.789 -1.195 . . . . 0.0 113.975 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -104.49 -16.99 14.9 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.609 1.563 . . . . 0.0 112.73 -178.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.496 HG23 HG23 ' C' ' 149' ' ' ILE . 56.1 m -109.3 -50.14 3.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.14 0.976 . . . . 0.0 111.694 175.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.8 p -52.97 -37.89 61.65 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.721 1.208 . . . . 0.0 112.826 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -52.95 -49.34 66.26 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.413 1.085 . . . . 0.0 112.737 171.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -67.56 -43.99 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.475 0.71 . . . . 0.0 110.83 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.12 -39.36 83.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 O-C-N 121.973 -0.454 . . . . 0.0 110.149 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HE1' HG11 ' A' ' 10' ' ' VAL . 21.5 t80 -66.48 -44.77 81.76 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.642 1.177 . . . . 0.0 113.058 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.69 -29.64 64.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.692 0.797 . . . . 0.0 112.851 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -65.79 -49.96 66.41 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.342 0.657 . . . . 0.0 111.683 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.6 mt -61.53 -38.39 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 O-C-N 121.038 -1.039 . . . . 0.0 111.175 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.37 -13.96 61.41 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 pttt -121.65 -17.7 7.38 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 29.9 m -142.73 -26.07 0.61 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.065 1.346 . . . . 0.0 113.386 -170.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.36 -98.54 0.15 Allowed Glycine 0 CA--C 1.525 0.709 0 CA-C-O 118.231 -1.316 . . . . 0.0 110.32 171.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.43 118.56 0.01 OUTLIER Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.971 2.224 . . . . 0.0 113.801 -176.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.5 -33.45 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.048 -1.266 . . . . 0.0 114.359 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -83.16 -28.61 29.24 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.521 1.129 . . . . 0.0 113.997 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.57 -38.21 83.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.996 1.318 . . . . 0.0 113.12 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.6 m -76.28 -18.57 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 125.086 1.354 . . . . 0.0 113.327 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -41.42 75.29 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.868 0.867 . . . . 0.0 112.606 171.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 124.964 1.306 . . . . 0.0 112.586 -176.78 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.9 p -80.11 54.25 1.9 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.187 1.795 . . . . 0.0 113.913 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -138.26 152.55 48.67 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.797 1.639 . . . . 0.0 111.547 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 78.4 mtp 48.57 33.87 4.48 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.735 1.614 . . . . 0.0 114.754 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.0 8.69 4.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.331 1.853 . . . . 0.0 114.883 -172.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -51.07 -40.73 59.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.494 1.517 . . . . 0.0 112.464 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -157.92 135.33 10.31 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.907 1.283 . . . . 0.0 110.526 166.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.3 mttp -131.05 171.06 13.67 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.345 1.458 . . . . 0.0 110.464 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 31.9 m -138.68 155.0 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.215 1.406 . . . . 0.0 111.011 171.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -104.27 126.13 51.12 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.049 1.34 . . . . 0.0 108.322 168.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.6 p -73.12 122.36 21.71 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -2.4 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 O-C-N 120.029 -1.669 . . . . 0.0 111.982 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -154.21 158.84 32.43 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.697 1.999 . . . . 0.0 111.418 -178.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.54 166.17 30.22 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.762 2.974 . . . . 0.0 113.152 174.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -144.54 145.94 32.1 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.208 1.403 . . . . 0.0 110.951 171.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 60.9 m -124.15 108.78 12.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.43 1.492 . . . . 0.0 110.122 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -34.27 76.8 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.937 1.295 . . . . 0.0 114.304 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.28 -141.8 45.06 Favored Glycine 0 CA--C 1.538 1.519 0 O-C-N 121.022 -1.049 . . . . 0.0 112.62 -169.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -71.58 4.33 3.2 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -172.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -98.42 150.4 21.66 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.782 1.174 . . . . 0.0 113.028 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.47 4.11 20.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.794 1.638 . . . . 0.0 113.816 -174.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 18.6 p -113.69 7.71 17.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.244 1.817 . . . . 0.0 112.305 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.0 mt -103.16 161.7 13.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.829 1.252 . . . . 0.0 112.582 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 51.4 tp -122.55 124.07 42.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.503 1.521 . . . . 0.0 110.07 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 51.9 p -110.54 151.14 27.95 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.554 1.541 . . . . 0.0 111.725 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -167.06 -177.85 3.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.66 1.584 . . . . 0.0 111.668 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -112.81 -177.1 3.06 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.885 1.674 . . . . 0.0 111.5 172.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -70.33 145.69 51.02 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.96 -1.088 . . . . 0.0 111.06 166.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.14 4.05 88.54 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.257 1.408 . . . . 0.0 113.632 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -83.51 167.23 17.58 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.702 1.201 . . . . 0.0 112.162 174.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -130.53 131.42 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.202 1.401 . . . . 0.0 109.868 -172.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.8 mm -126.24 133.71 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 124.78 1.232 . . . . 0.0 109.248 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 35.2 m -94.79 122.07 37.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.041 0.936 . . . . 0.0 109.644 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.95 137.45 55.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.387 0.675 . . . . 0.0 111.434 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 94.6 mt -114.49 -4.75 12.85 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.86 1.264 . . . . 0.0 113.054 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.2 pt -118.65 153.17 52.12 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 125.861 1.664 . . . . 0.0 110.489 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.83 -25.17 14.71 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.271 2.647 . . . . 0.0 114.452 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -155.6 161.21 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.597 1.559 . . . . 0.0 111.863 -177.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' B' ' 109' ' ' LEU . 1.4 pm0 -71.37 167.89 18.57 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 176.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.9 121.87 13.68 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.792 0.837 . . . . 0.0 111.405 173.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 t0 52.57 22.98 2.38 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.14 -5.51 82.74 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.543 1.544 . . . . 0.0 115.865 -172.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.467 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.2 m95 -87.92 133.42 33.93 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.493 1.917 . . . . 0.0 111.769 172.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.3 mm? -120.4 149.07 42.94 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 126.458 1.903 . . . . 0.0 109.281 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -117.46 134.96 54.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.878 0.847 . . . . 0.0 110.343 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.06 -179.12 35.6 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 115.053 -0.976 . . . . 0.0 113.926 -171.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -125.44 128.46 48.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.969 1.708 . . . . 0.0 109.403 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -70.79 131.76 44.31 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.792 0.837 . . . . 0.0 112.633 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -73.64 5.98 3.49 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.803 1.779 . . . . 0.0 115.803 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.5 m -123.46 -20.18 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 32.6 t -136.78 -15.46 1.57 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.563 1.545 . . . . 0.0 112.591 -173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm 62.56 17.44 9.63 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.306 1.843 . . . . 0.0 113.437 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.24 141.28 57.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.478 1.111 . . . . 0.0 110.528 168.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -122.72 151.91 41.1 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.506 1.522 . . . . 0.0 110.978 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 166.01 168.0 27.51 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 123.865 0.745 . . . . 0.0 112.314 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -73.52 131.83 42.19 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -128.75 153.9 79.84 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.172 0.989 . . . . 0.0 112.018 173.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.74 115.9 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.512 2.808 . . . . 0.0 112.244 175.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.509 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.1 t -57.31 -34.73 69.02 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.59 -0.694 . . . . 0.0 112.534 174.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 19.9 m -60.98 -29.52 69.73 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -80.96 10.01 5.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.527 1.131 . . . . 0.0 113.597 169.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 8.2 p -136.54 168.39 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.538 1.535 . . . . 0.0 111.942 -178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -141.04 150.33 42.84 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.669 1.188 . . . . 0.0 110.386 169.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . 0.523 HD23 ' H ' ' B' ' 129' ' ' LEU . 1.7 pt? -55.52 163.76 1.2 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.787 1.235 . . . . 0.0 113.841 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 39.7 mt -128.8 26.12 5.58 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.044 1.738 . . . . 0.0 111.898 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -63.07 156.69 24.15 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 121.58 -0.7 . . . . 0.0 112.174 169.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.388 1.475 . . . . 0.0 114.413 -178.638 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.502 -1.237 . . . . 0.0 113.066 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -67.78 -35.82 20.42 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.093 1.862 . . . . 0.0 113.646 -163.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -40.19 61.2 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.876 0.47 . . . . 0.0 111.703 175.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.6 t -56.61 -40.56 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 0.0 111.856 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.36 68.02 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.278 -1.514 . . . . 0.0 114.001 175.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -18.72 62.25 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.573 1.079 . . . . 0.0 112.783 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -109.43 -21.09 12.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.465 2.306 . . . . 0.0 113.463 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.496 HD21 HD11 ' A' ' 36' ' ' ILE . 63.6 tp -60.38 -47.96 83.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.763 0.711 . . . . 0.0 111.466 169.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 44.1 mtt -57.74 -36.25 71.81 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -177.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -64.34 -39.88 94.77 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.271 1.028 . . . . 0.0 112.401 175.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -65.82 -49.24 68.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.853 0.752 . . . . 0.0 112.134 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.81 -29.75 70.96 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.801 -0.562 . . . . 0.0 112.394 -174.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.43 65.44 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.827 1.251 . . . . 0.0 113.175 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.13 -20.89 47.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.464 1.506 . . . . 0.0 112.418 -177.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.91 -1.08 12.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.138 1.775 . . . . 0.0 112.271 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.78 17.8 65.46 Favored Glycine 0 CA--C 1.54 1.624 0 C-N-CA 124.981 1.277 . . . . 0.0 115.052 -172.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.496 HG23 HG23 ' A' ' 46' ' ' THR . 38.0 mm -64.88 153.71 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.913 1.357 . . . . 0.0 109.721 168.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -146.8 147.61 30.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.724 1.21 . . . . 0.0 111.478 174.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -66.01 155.43 69.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.936 2.424 . . . . 0.0 111.086 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.07 -17.9 64.85 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.52 -25.13 64.23 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -134.5 72.46 1.46 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.987 2.115 . . . . 0.0 110.272 -172.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 10.8 mtt -97.65 152.31 19.21 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.723 0.809 . . . . 0.0 111.774 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.11 141.21 18.4 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.005 1.322 . . . . 0.0 111.661 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -144.49 155.62 43.79 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.139 1.376 . . . . 0.0 112.642 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.37 -52.02 9.84 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm 64.06 133.21 0.03 OUTLIER Pre-proline 0 CA--C 1.56 1.343 0 C-N-CA 127.213 2.205 . . . . 0.0 113.671 -172.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.12 172.56 9.74 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 125.02 3.813 . . . . 0.0 113.797 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.0 -78.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 123.472 2.781 . . . . 0.0 114.135 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.508 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.17 163.17 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 129.258 3.023 . . . . 0.0 112.758 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.508 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 74.7 Cg_endo -71.63 173.08 13.12 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.264 3.309 . . . . 0.0 113.926 173.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -88.91 5.17 45.25 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.464 1.506 . . . . 0.0 114.623 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.0 p90 -138.18 159.2 69.17 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 125.492 1.517 . . . . 0.0 111.415 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.72 158.18 53.88 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.804 2.336 . . . . 0.0 113.812 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.07 132.31 95.02 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 122.94 0.496 . . . . 0.0 112.255 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.61 166.21 26.69 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.743 2.962 . . . . 0.0 112.955 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -126.33 152.08 73.35 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 125.434 1.494 . . . . 0.0 112.834 -171.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 166.4 23.07 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.513 3.475 . . . . 0.0 113.416 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.31 78.56 0.85 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.768 3.646 . . . . 0.0 112.127 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 61.6 t -138.57 137.68 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 125.782 1.633 . . . . 0.0 108.806 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -126.68 149.38 49.58 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.78 1.232 . . . . 0.0 110.867 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -68.14 -23.56 64.9 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -87.54 -16.86 33.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -76.57 172.55 12.83 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.318 1.047 . . . . 0.0 112.338 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 4.8 t -129.05 44.91 2.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.605 1.562 . . . . 0.0 111.29 -177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -136.15 152.36 75.21 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 126.601 1.96 . . . . 0.0 111.903 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.243 3.295 . . . . 0.0 113.529 -177.988 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -144.09 122.97 12.71 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.964 1.306 . . . . 0.0 110.142 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -153.56 -43.84 0.09 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.306 1.042 . . . . 0.0 112.713 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -149.44 175.17 11.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.855 1.662 . . . . 0.0 112.299 174.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -121.88 -64.91 1.17 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.69 1.596 . . . . 0.0 112.606 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -15.63 63.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.0 pt -142.05 -172.79 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 128.008 2.523 . . . . 0.0 108.913 -178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 127.21 -21.88 5.71 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.343 0.973 . . . . 0.0 112.196 173.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -61.67 -40.5 95.15 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.672 1.589 . . . . 0.0 113.219 171.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.48 158.57 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.315 1.046 . . . . 0.0 111.24 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.01 56.94 0.73 Allowed Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.973 1.273 . . . . 0.0 112.361 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -103.52 150.56 23.79 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 118.364 1.082 . . . . 0.0 112.276 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.6 141.95 32.74 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.677 1.191 . . . . 0.0 114.123 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.11 7.05 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.903 1 C-N-CA 125.631 4.221 . . . . 0.0 115.41 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.66 -25.75 5.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.338 1.455 . . . . 0.0 113.772 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.8 p -132.95 -29.7 1.44 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.147 0.979 . . . . 0.0 113.397 -172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.54 -157.37 15.83 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.584 1.088 . . . . 0.0 114.365 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -69.56 142.46 53.6 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.751 0.82 . . . . 0.0 111.602 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.55 69.23 10.05 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 122.071 0.939 . . . . 0.0 112.331 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD21 HD23 ' A' ' 41' ' ' LEU . 10.7 mt -45.01 -36.11 3.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.496 2.319 . . . . 0.0 113.489 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -59.82 -30.2 68.77 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.426 1.49 . . . . 0.0 113.654 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -140.13 27.86 2.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.025 0.93 . . . . 0.0 113.158 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.53 150.06 16.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.89 0.876 . . . . 0.0 112.601 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.62 156.62 42.8 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.792 1.237 . . . . 0.0 113.038 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -64.73 -12.28 33.2 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.202 3.268 . . . . 0.0 114.09 -177.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.58 -8.57 8.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.149 1.38 . . . . 0.0 113.028 -178.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -75.22 -68.17 0.58 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 111.484 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.49 -31.84 64.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.455 0.702 . . . . 0.0 112.859 174.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.64 -46.05 84.18 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.767 1.227 . . . . 0.0 110.094 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.77 HD11 HD22 ' C' ' 140' ' ' LEU . 0.9 OUTLIER -65.86 -43.81 87.29 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.525 1.53 . . . . 0.0 111.574 172.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -60.02 -44.07 94.86 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 118.436 0.562 . . . . 0.0 110.543 -176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -69.16 -25.35 64.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.922 1.289 . . . . 0.0 113.265 176.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 15.0 tpp -71.42 -53.52 13.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.666 1.186 . . . . 0.0 110.744 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.33 -30.02 65.7 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.119 0.568 . . . . 0.0 112.305 -178.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.45 7.51 10.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.827 1.203 . . . . 0.0 115.289 175.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -67.28 138.75 22.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 125.925 1.69 . . . . 0.0 110.324 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 84.9 p -103.26 163.56 12.17 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.85 -30.15 61.0 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 173.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.48 94.96 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.849 -0.532 . . . . 0.0 112.366 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -68.44 -38.06 80.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.824 0.449 . . . . 0.0 111.513 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.49 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.95 -24.64 67.8 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 125.763 1.625 . . . . 0.0 113.746 175.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -98.11 -1.16 42.97 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.145 1.378 . . . . 0.0 113.234 176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -87.65 113.81 23.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.524 1.129 . . . . 0.0 109.295 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.476 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.1 mpt_? -59.98 -15.82 25.41 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -98.35 -29.01 13.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.858 1.263 . . . . 0.0 112.42 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.601 HG23 HG23 ' C' ' 149' ' ' ILE . 23.7 m -96.61 -51.53 4.28 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.834 0.853 . . . . 0.0 111.555 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.4 p -55.12 -34.5 63.76 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.85 1.26 . . . . 0.0 112.857 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -53.6 -50.31 65.92 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.586 1.154 . . . . 0.0 112.971 170.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.24 -42.94 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.618 0.767 . . . . 0.0 110.757 179.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.87 -40.69 87.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 122.003 -0.436 . . . . 0.0 110.481 178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -65.37 -43.61 90.21 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.902 -1.124 . . . . 0.0 112.896 174.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.52 -32.6 58.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.364 0.666 . . . . 0.0 112.603 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' C' ' 140' ' ' LEU . 26.8 t80 -66.39 -47.28 73.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.498 0.719 . . . . 0.0 112.186 173.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -63.29 -37.87 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 120.32 -1.488 . . . . 0.0 110.877 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.67 -12.92 57.66 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.12 -11.25 5.3 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -173.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -152.1 -26.76 0.18 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.923 1.289 . . . . 0.0 113.187 -169.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -77.05 -113.63 0.15 Allowed Glycine 0 CA--C 1.526 0.745 0 CA-C-O 118.615 -1.103 . . . . 0.0 110.601 165.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.85 124.71 0.03 OUTLIER Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.606 2.05 . . . . 0.0 113.746 -168.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.8 p -58.83 -34.91 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.148 -1.207 . . . . 0.0 113.668 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -81.82 -30.18 32.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.155 0.982 . . . . 0.0 113.032 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.01 -46.86 66.91 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.306 1.442 . . . . 0.0 112.432 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.58 -29.57 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.783 1.233 . . . . 0.0 111.684 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -9.91 47.86 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.149 1.78 . . . . 0.0 115.154 172.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 . . . . . 0 C--O 1.254 1.341 0 C-N-CA 128.22 2.608 . . . . 0.0 114.494 178.24 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.752 0 N-CA-C 112.107 -0.397 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.5 m -74.89 -17.13 60.62 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -112.93 -149.16 0.44 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.653 1.581 . . . . 0.0 109.422 176.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 45.6 mmm -67.08 161.62 24.09 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.948 -1.095 . . . . 0.0 111.539 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -58.63 154.85 13.58 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.994 0.918 . . . . 0.0 112.679 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -59.96 158.15 11.38 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.917 0.887 . . . . 0.0 111.769 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 73.83 105.51 0.07 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.436 2.294 . . . . 0.0 111.495 -171.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' B' ' 98' ' ' THR . 23.2 mtmm -132.87 164.65 26.43 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.608 1.163 . . . . 0.0 111.311 176.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 22.5 m -139.12 149.74 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 111.263 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -95.79 126.62 41.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 167.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.9 p -72.28 136.96 46.41 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 169.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.25 -1.7 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.668 1.187 . . . . 0.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -153.06 156.55 32.76 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 126.079 1.752 . . . . 0.0 110.97 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.59 161.86 44.01 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.231 2.62 . . . . 0.0 113.129 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -144.13 149.38 36.43 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.409 1.484 . . . . 0.0 110.581 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 88.1 m -134.4 118.34 17.32 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.534 1.534 . . . . 0.0 110.08 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.37 79.87 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.54 57.55 8.94 Favored Glycine 0 CA--C 1.537 1.464 0 O-C-N 121.433 -0.792 . . . . 0.0 113.891 178.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 18.8 m 68.81 45.9 0.95 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.647 1.579 . . . . 0.0 114.321 176.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -120.64 164.92 15.79 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.761 1.625 . . . . 0.0 111.931 176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.401 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.1 OUTLIER -123.33 9.14 9.11 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 125.679 1.592 . . . . 0.0 113.932 -177.448 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 32.2 p -131.42 11.25 4.9 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 126.967 2.107 . . . . 0.0 112.447 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.6 mt -114.19 159.82 19.68 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.067 1.347 . . . . 0.0 112.261 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp -121.78 124.64 44.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.216 1.406 . . . . 0.0 110.306 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 46.7 m -108.5 147.13 32.15 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.587 1.155 . . . . 0.0 111.46 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -164.45 -178.93 5.69 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.441 1.496 . . . . 0.0 112.276 -173.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -122.83 164.95 17.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.515 1.926 . . . . 0.0 111.756 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -53.81 136.71 39.75 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.881 -1.137 . . . . 0.0 111.732 174.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 92.57 -4.68 76.57 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.488 1.042 . . . . 0.0 113.834 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -78.55 156.88 28.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.111 0.955 . . . . 0.0 112.328 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.0 t -118.99 132.49 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.75 1.62 . . . . 0.0 111.038 -171.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.55 142.01 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.31 1.444 . . . . 0.0 109.775 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . 0.435 HG23 ' HG2' ' B' ' 73' ' ' LYS . 2.9 m -106.44 119.09 38.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 109.946 -178.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.4 144.21 57.22 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.812 1.187 . . . . 0.0 111.435 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.69 -1.99 10.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.12 1.368 . . . . 0.0 112.679 177.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 pt -126.38 154.62 74.87 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 126.098 1.759 . . . . 0.0 110.695 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.89 -25.92 10.04 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.426 2.751 . . . . 0.0 114.895 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -154.25 161.51 41.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 112.378 -175.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.02 165.88 24.37 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.95 122.36 12.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.271 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.9 t0 53.2 24.03 3.45 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.24 -4.33 77.25 Favored Glycine 0 CA--C 1.542 1.749 0 C-N-CA 125.639 1.59 . . . . 0.0 115.894 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.481 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.7 m95 -88.22 133.7 33.97 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.703 2.001 . . . . 0.0 111.797 173.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.481 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -120.7 150.8 40.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.584 1.953 . . . . 0.0 109.223 175.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -119.64 135.3 54.87 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.552 0.691 . . . . 0.0 110.411 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.54 -174.87 36.97 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 115.383 -0.826 . . . . 0.0 114.516 -173.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -129.66 122.15 28.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.428 1.891 . . . . 0.0 110.572 -173.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.432 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.27 130.12 41.96 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.234 1.013 . . . . 0.0 112.873 -177.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.82 9.04 3.11 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -175.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.1 m -124.92 -18.78 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 124.68 1.192 . . . . 0.0 114.094 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 48.2 t -134.75 -18.71 1.86 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.964 1.706 . . . . 0.0 112.521 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? 63.28 16.82 9.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.959 2.104 . . . . 0.0 112.517 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.56 139.54 56.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.294 1.438 . . . . 0.0 110.861 168.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 mtm180 -119.24 148.32 43.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.619 1.568 . . . . 0.0 111.404 177.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 170.0 165.69 27.77 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 123.951 0.786 . . . . 0.0 111.965 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -71.97 135.21 46.35 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -130.56 153.4 81.44 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.064 1.345 . . . . 0.0 112.291 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.29 116.57 4.75 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.768 2.979 . . . . 0.0 112.949 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.446 ' HB2' HD23 ' B' ' 109' ' ' LEU . 2.4 t -61.47 -27.66 68.73 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.474 -0.767 . . . . 0.0 112.992 172.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 16.9 m -63.15 -27.9 69.69 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.062 -1.024 . . . . 0.0 113.365 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -85.87 7.91 22.22 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 114.011 170.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 11.2 p -132.38 172.67 12.16 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.425 -1.422 . . . . 0.0 111.589 179.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -134.13 -85.25 0.43 Allowed 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.402 -0.811 . . . . 0.0 112.144 174.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -166.6 174.77 8.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.537 1.935 . . . . 0.0 111.566 -174.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 13.4 mt -132.93 22.17 4.17 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.725 1.61 . . . . 0.0 112.752 174.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -60.9 162.36 7.0 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.972 0.909 . . . . 0.0 112.254 166.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.567 1.947 . . . . 0.0 114.066 -175.731 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.356 -1.307 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.52 -34.25 20.44 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.939 1.76 . . . . 0.0 113.5 -166.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.89 -28.43 63.51 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.83 -38.76 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.903 0.881 . . . . 0.0 111.2 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.25 -31.84 73.2 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.879 -1.138 . . . . 0.0 113.227 176.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -70.52 -23.63 62.68 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.127 -0.983 . . . . 0.0 112.573 -177.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -97.3 -24.35 15.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.865 2.066 . . . . 0.0 112.873 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.77 HD22 HD11 ' A' ' 30' ' ' LEU . 64.2 tp -64.72 -47.37 78.54 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.942 0.792 . . . . 0.0 112.519 172.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 20.2 mtt -57.69 -34.42 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.321 0.51 . . . . 0.0 112.182 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -64.08 -39.78 94.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.326 1.05 . . . . 0.0 111.976 175.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -68.21 -49.32 61.53 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.754 0.821 . . . . 0.0 112.431 175.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 59.5 mt -66.53 -24.07 66.32 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -173.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.97 -22.34 60.71 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.559 1.144 . . . . 0.0 112.998 176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -77.4 -21.16 53.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.369 1.468 . . . . 0.0 112.343 -177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -116.86 2.47 12.82 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.866 1.666 . . . . 0.0 112.019 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.19 68.09 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.471 1.51 . . . . 0.0 114.816 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.601 HG23 HG23 ' A' ' 46' ' ' THR . 8.2 mm -63.99 -65.68 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.455 1.102 . . . . 0.0 112.502 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 56.09 157.95 0.07 OUTLIER Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 129.134 2.974 . . . . 0.0 114.449 -172.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.99 159.31 52.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 111.874 173.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.82 -23.34 66.03 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.196 0.998 . . . . 0.0 112.926 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 -57.03 -12.11 1.9 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.432 1.893 . . . . 0.0 115.325 165.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -128.92 33.27 4.64 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.149 1.779 . . . . 0.0 111.626 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 30.5 mtm -130.01 158.58 39.21 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 112.43 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.85 179.65 8.89 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 111.97 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.52 161.77 40.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.466 1.506 . . . . 0.0 113.461 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.6 p-80 -85.99 176.08 8.24 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.919 1.688 . . . . 0.0 112.465 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -125.53 136.05 27.78 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 125.375 1.47 . . . . 0.0 109.839 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.15 174.09 7.52 Favored 'Trans proline' 0 CA--C 1.549 1.267 1 C-N-CA 125.768 4.312 . . . . 0.0 114.206 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.9 -84.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.765 2.977 . . . . 0.0 113.192 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 159.28 163.06 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 128.5 2.72 . . . . 0.0 112.533 -174.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.504 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 72.8 Cg_endo -70.81 172.37 13.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.846 3.031 . . . . 0.0 113.509 173.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -90.4 7.35 39.11 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.355 1.462 . . . . 0.0 114.231 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -139.01 158.79 69.03 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.515 1.526 . . . . 0.0 111.464 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -71.85 158.5 52.8 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.852 2.368 . . . . 0.0 113.988 178.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.24 132.59 94.01 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.81 163.85 35.71 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.854 3.036 . . . . 0.0 112.797 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.8 p -123.28 152.43 64.06 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 125.305 1.442 . . . . 0.0 113.167 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.27 166.58 24.76 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 124.564 3.51 . . . . 0.0 113.431 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.31 70.64 1.86 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.001 3.8 . . . . 0.0 112.551 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.45 93.55 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.089 1.355 . . . . 0.0 109.359 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -142.32 172.09 13.16 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.652 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -56.38 150.21 15.27 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.129 0.972 . . . . 0.0 112.613 172.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -79.93 126.71 31.36 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.65 0.78 . . . . 0.0 110.915 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -107.95 -43.04 4.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.766 0.826 . . . . 0.0 113.04 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 38.5 m -148.19 -34.61 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -172.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -118.36 153.1 51.62 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.287 1.835 . . . . 0.0 110.393 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.882 3.055 . . . . 0.0 113.015 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -74.4 66.8 1.38 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.534 1.934 . . . . 0.0 113.994 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -133.56 177.59 7.58 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.223 1.809 . . . . 0.0 111.917 -178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -124.53 176.86 6.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.009 1.724 . . . . 0.0 112.743 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -111.44 -77.09 0.59 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.754 1.621 . . . . 0.0 111.935 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.22 -15.82 28.01 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.1 pt -138.05 -9.59 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 125.968 1.707 . . . . 0.0 113.587 -172.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -85.63 -20.9 55.37 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 123.866 0.746 . . . . 0.0 113.297 178.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -53.89 -30.07 44.43 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.969 1.308 . . . . 0.0 113.039 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.485 HG13 ' H ' ' A' ' 12' ' ' TRP . 0.7 OUTLIER -69.77 -20.75 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.648 1.979 . . . . 0.0 114.437 -177.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.56 27.02 53.78 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.382 1.468 . . . . 0.0 116.261 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.485 ' H ' HG13 ' A' ' 10' ' ' VAL . 81.8 t90 -81.38 146.29 30.39 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.908 1.354 . . . . 0.0 111.559 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -136.51 143.94 45.31 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 172.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.05 5.35 2.23 Favored 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.383 4.055 . . . . 0.0 115.406 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -117.14 -24.22 7.6 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.326 1.45 . . . . 0.0 113.87 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.5 p -132.73 -32.56 1.26 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.342 1.057 . . . . 0.0 113.042 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 108.05 -157.6 15.27 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.136 1.351 . . . . 0.0 113.601 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -63.73 150.45 44.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.173 0.989 . . . . 0.0 111.495 179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -87.9 71.24 9.49 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.249 0.62 . . . . 0.0 112.067 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 20' ' ' LEU . 3.0 mm? -46.75 -42.53 16.99 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.786 -1.196 . . . . 0.0 113.92 -177.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -60.83 -20.7 62.18 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.202 1.401 . . . . 0.0 114.454 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -140.84 22.61 2.28 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.769 1.627 . . . . 0.0 112.62 -175.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.63 153.2 28.56 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.829 0.851 . . . . 0.0 112.105 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.17 158.7 62.48 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 124.019 0.927 . . . . 0.0 112.986 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.95 -14.01 42.85 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.401 3.4 . . . . 0.0 114.207 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.66 -14.54 10.2 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.763 1.225 . . . . 0.0 112.7 -177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.59 -64.09 1.19 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.105 0.962 . . . . 0.0 112.236 -171.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.77 -33.12 60.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.826 171.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.82 -46.62 87.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.823 1.249 . . . . 0.0 110.437 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.75 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -65.0 -45.94 83.48 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.382 1.473 . . . . 0.0 111.838 173.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 41' ' ' LEU . 23.4 m-85 -59.07 -44.92 91.9 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.72 0.772 . . . . 0.0 110.275 -176.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.67 -21.26 62.61 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.536 1.934 . . . . 0.0 113.239 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.9 tpp -75.9 -53.83 7.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.344 1.457 . . . . 0.0 111.332 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.2 t -69.02 -33.37 73.52 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.324 0.649 . . . . 0.0 111.85 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.16 13.82 6.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.823 1.202 . . . . 0.0 114.108 177.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.455 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -70.72 131.88 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 118.412 1.106 . . . . 0.0 109.38 174.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.5 t -97.73 159.62 14.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.103 0.561 . . . . 0.0 111.644 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -58.92 -24.37 62.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.25 97.33 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 171.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -68.76 -36.56 78.49 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.348 0.659 . . . . 0.0 110.887 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 31' ' ' PHE . 4.9 mp -63.56 -24.25 67.73 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.815 1.646 . . . . 0.0 113.648 174.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -100.3 3.17 43.23 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.425 1.09 . . . . 0.0 113.291 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -89.2 113.48 24.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.298 1.039 . . . . 0.0 109.386 178.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.487 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 1.2 mpt_? -61.07 -15.49 33.24 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 120.875 -1.141 . . . . 0.0 113.783 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -96.86 -30.73 12.97 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.904 1.282 . . . . 0.0 112.268 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.589 HG23 HG23 ' C' ' 149' ' ' ILE . 8.2 m -94.66 -52.09 4.44 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.894 0.878 . . . . 0.0 111.611 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 61.3 p -54.89 -35.96 64.65 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.064 1.346 . . . . 0.0 112.565 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.48 -49.9 66.49 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.723 1.209 . . . . 0.0 112.948 171.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.82 -43.76 85.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.512 0.725 . . . . 0.0 110.683 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.71 -41.64 89.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 122.045 -0.409 . . . . 0.0 110.323 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -64.92 -41.48 95.53 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.174 0.99 . . . . 0.0 113.042 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -56.51 -30.8 63.45 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.506 -0.746 . . . . 0.0 112.758 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -67.82 -45.97 73.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.021 0.528 . . . . 0.0 111.95 171.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mt -64.26 -39.53 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 119.139 0.881 . . . . 0.0 111.273 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -14.18 61.88 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 pttm -121.37 -15.3 8.12 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.39 -27.78 0.46 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.925 1.29 . . . . 0.0 113.592 -167.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -81.47 -108.81 0.36 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.54 125.21 0.01 OUTLIER Glycine 0 CA--C 1.537 1.442 0 C-N-CA 126.156 1.836 . . . . 0.0 113.538 -169.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.57 -34.69 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.309 -1.113 . . . . 0.0 113.706 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.31 -28.29 25.36 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.875 1.27 . . . . 0.0 113.663 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -70.52 -46.5 63.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.048 1.339 . . . . 0.0 112.483 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -65.97 -24.28 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.247 1.019 . . . . 0.0 111.838 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -14.45 49.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.179 1.392 . . . . 0.0 114.642 173.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.1 t30 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 126.639 1.976 . . . . 0.0 113.893 -171.856 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 CA-C-O 121.158 0.31 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.5 t 52.35 36.82 20.79 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 126.297 1.839 . . . . 0.0 115.169 175.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -92.38 19.71 6.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.269 1.428 . . . . 0.0 113.722 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 79.0 mtp -130.84 163.99 26.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.898 1.679 . . . . 0.0 111.835 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -58.07 133.52 55.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.6 1.16 . . . . 0.0 110.301 174.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -67.09 31.59 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.641 2.376 . . . . 0.0 116.812 -174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -128.39 112.74 14.74 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.194 1.397 . . . . 0.0 110.164 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 19.9 mtmm -133.44 161.92 33.26 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.919 0.887 . . . . 0.0 111.47 178.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.01 146.81 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.65 1.18 . . . . 0.0 110.763 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -92.77 127.15 38.17 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 15.3 p -70.75 140.08 51.26 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -112.52 -4.23 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.901 1.28 . . . . 0.0 111.937 178.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -152.11 158.14 33.83 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.161 1.784 . . . . 0.0 111.116 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -70.93 162.9 41.07 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.39 2.727 . . . . 0.0 112.81 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -140.56 131.78 26.53 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.688 1.195 . . . . 0.0 110.719 170.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 23.3 m -103.46 97.0 7.12 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.145 1.378 . . . . 0.0 110.163 -179.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -24.68 66.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.972 1.309 . . . . 0.0 114.074 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.15 -143.24 48.33 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.185 -0.947 . . . . 0.0 113.136 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.7 p -74.25 -3.75 31.93 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -69.37 161.33 29.59 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -176.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -120.53 5.07 10.63 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.413 1.885 . . . . 0.0 114.024 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.1 p -124.17 15.21 9.11 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.982 1.713 . . . . 0.0 111.995 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.9 mt -114.66 154.2 28.83 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.777 1.231 . . . . 0.0 112.02 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.0 tp -117.01 113.82 22.89 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.038 1.335 . . . . 0.0 110.07 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.8 p -93.52 152.48 19.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.432 1.093 . . . . 0.0 112.533 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -167.78 -179.83 4.44 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.874 1.67 . . . . 0.0 111.697 -177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -110.31 -177.79 3.34 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.922 1.689 . . . . 0.0 111.293 170.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -67.13 146.17 54.54 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.135 -0.978 . . . . 0.0 111.227 166.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 1.82 90.17 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.374 0.988 . . . . 0.0 113.619 174.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -80.0 167.21 20.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 175.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 53.7 t -129.91 131.21 66.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.991 1.316 . . . . 0.0 110.415 -172.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.87 135.48 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.104 1.362 . . . . 0.0 109.753 -176.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.8 m -100.61 114.51 28.26 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.76 1.224 . . . . 0.0 109.792 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.23 141.59 57.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.574 0.702 . . . . 0.0 110.965 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.4 mt -117.86 -5.2 11.06 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.16 1.384 . . . . 0.0 112.79 -177.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.3 pt -119.48 155.12 54.45 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.359 1.463 . . . . 0.0 111.543 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.12 -36.16 13.07 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.138 2.559 . . . . 0.0 114.062 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -151.08 162.44 40.85 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.882 1.273 . . . . 0.0 112.209 -173.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.91 165.81 23.4 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 175.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 122.02 12.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.112 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.6 t0 52.32 24.75 3.03 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.393 -1.442 . . . . 0.0 114.699 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.4 -3.96 79.6 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.698 1.618 . . . . 0.0 116.0 -173.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.47 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.99 133.71 33.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.448 1.899 . . . . 0.0 111.751 172.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.47 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.4 mm? -120.13 152.88 36.99 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 126.571 1.948 . . . . 0.0 109.265 174.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -121.79 135.37 54.92 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.84 0.829 . . . . 0.0 110.296 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.16 -176.73 35.48 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.012 -0.994 . . . . 0.0 113.654 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -125.76 127.73 46.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.834 1.654 . . . . 0.0 109.846 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -68.98 133.51 48.26 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.962 0.905 . . . . 0.0 112.706 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.92 9.38 2.95 Favored 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 m -123.13 -22.16 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -138.0 -12.17 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.262 1.425 . . . . 0.0 113.027 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 63.05 20.56 12.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.021 1.728 . . . . 0.0 112.914 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.18 139.26 54.59 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.096 1.358 . . . . 0.0 110.658 170.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -122.63 151.31 41.6 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.23 1.412 . . . . 0.0 111.249 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 165.54 167.95 26.95 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.272 0.939 . . . . 0.0 111.664 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -72.61 134.05 44.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 172.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -127.97 153.38 78.31 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 124.847 1.259 . . . . 0.0 112.15 174.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.31 118.02 5.45 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.397 2.731 . . . . 0.0 112.704 176.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.446 ' CB ' HD23 ' B' ' 109' ' ' LEU . 0.1 OUTLIER -56.99 -37.3 71.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.726 -0.609 . . . . 0.0 112.399 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 20.3 m -61.91 -26.71 68.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.398 1.479 . . . . 0.0 114.033 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -85.66 12.81 8.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.029 1.332 . . . . 0.0 113.565 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.7 p -137.04 171.87 13.85 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.77 1.628 . . . . 0.0 111.543 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.1 -83.18 0.47 Allowed 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 172.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.1 pp -168.17 172.55 8.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.117 1.767 . . . . 0.0 111.681 -171.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 17.0 mt -135.43 15.51 3.44 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.629 1.571 . . . . 0.0 113.127 173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -70.14 -11.15 60.68 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.698 1.999 . . . . 0.0 112.595 -177.855 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 117.104 -1.427 . . . . 0.0 113.304 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.7 -33.85 33.78 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.996 1.798 . . . . 0.0 113.143 -169.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.83 -36.62 62.4 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.347 0.659 . . . . 0.0 112.524 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.65 -31.74 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 O-C-N 120.559 -1.338 . . . . 0.0 111.731 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.95 71.26 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.496 -1.378 . . . . 0.0 113.452 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -26.94 68.01 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.289 0.95 . . . . 0.0 113.083 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 ptp85 -93.65 -26.55 17.01 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.017 1.727 . . . . 0.0 112.867 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.75 HD22 HD11 ' A' ' 30' ' ' LEU . 54.6 tp -63.88 -47.39 80.87 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.996 0.817 . . . . 0.0 112.385 173.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 33.0 mtt -58.04 -33.4 68.96 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -65.25 -40.33 93.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.09 0.956 . . . . 0.0 112.326 174.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -66.86 -47.99 70.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.021 0.828 . . . . 0.0 112.663 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 63.6 mt -67.18 -23.78 65.8 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -73.98 -21.22 60.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.708 1.203 . . . . 0.0 113.109 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.23 -21.32 46.37 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.162 1.385 . . . . 0.0 112.418 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -116.01 1.25 13.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.872 1.669 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.71 25.07 70.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.324 1.44 . . . . 0.0 114.779 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.589 HG23 HG23 ' A' ' 46' ' ' THR . 6.7 mm -62.72 -65.6 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 118.399 1.099 . . . . 0.0 112.279 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 52.85 157.63 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 129.534 3.133 . . . . 0.0 114.977 -172.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.76 154.14 75.13 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.552 2.168 . . . . 0.0 111.838 174.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.32 -26.1 68.33 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.557 1.143 . . . . 0.0 112.452 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -7.92 19.46 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.614 1.566 . . . . 0.0 114.144 172.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.96 2.04 53.22 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.672 1.189 . . . . 0.0 112.521 171.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.1 mtm -121.61 26.14 8.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.651 1.58 . . . . 0.0 112.606 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.54 -173.05 3.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.95 2.1 . . . . 0.0 111.256 -174.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.25 156.81 14.67 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 172.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -73.59 171.25 13.57 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.481 1.513 . . . . 0.0 112.738 167.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 16.6 mm -129.04 136.36 29.06 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.526 1.531 . . . . 0.0 109.925 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.48 173.41 8.84 Favored 'Trans proline' 0 CA--C 1.551 1.372 1 C-N-CA 125.778 4.319 . . . . 0.0 114.203 177.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.96 -78.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 123.851 3.034 . . . . 0.0 114.081 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.503 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 154.75 162.69 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 129.021 2.929 . . . . 0.0 112.883 -173.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.503 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 90.9 Cg_endo -71.79 170.95 17.5 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.296 3.33 . . . . 0.0 113.765 173.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.95 -0.82 50.35 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.222 1.409 . . . . 0.0 114.639 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 22.4 p90 -135.22 158.92 73.66 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.318 1.447 . . . . 0.0 111.754 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -71.56 158.62 53.33 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.867 2.378 . . . . 0.0 113.957 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.67 134.7 95.41 Favored Pre-proline 0 CA--C 1.549 0.941 0 O-C-N 121.854 -0.529 . . . . 0.0 112.23 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 168.55 18.67 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.898 3.065 . . . . 0.0 112.753 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 24.5 p -130.03 150.95 77.43 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 125.032 1.333 . . . . 0.0 112.777 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.81 166.98 22.56 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 124.471 3.447 . . . . 0.0 113.476 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.8 62.27 3.07 Favored 'Trans proline' 0 CA--C 1.543 0.939 1 C-N-CA 125.304 4.003 . . . . 0.0 113.127 177.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 38.2 t -138.06 144.3 31.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.212 1.405 . . . . 0.0 109.553 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -132.13 44.52 2.89 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.141 1.376 . . . . 0.0 111.897 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -72.44 176.54 5.28 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.993 1.317 . . . . 0.0 113.585 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 37.9 mp0 -130.95 161.05 32.76 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.537 1.535 . . . . 0.0 111.773 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -61.55 159.55 12.87 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 48.2 m -147.57 173.95 12.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.346 1.458 . . . . 0.0 112.574 176.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -130.38 153.94 81.42 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.062 2.145 . . . . 0.0 111.053 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.954 3.103 . . . . 0.0 113.137 178.237 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -155.14 -174.01 4.8 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.113 1.365 . . . . 0.0 111.763 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -133.35 35.0 3.47 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.667 1.987 . . . . 0.0 112.258 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -141.63 177.16 8.34 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.894 1.678 . . . . 0.0 113.094 -172.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -116.16 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.608 1.563 . . . . 0.0 111.676 -179.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.65 -4.3 6.04 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -138.52 -31.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 125.458 1.503 . . . . 0.0 113.874 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.32 -24.81 61.82 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.955 1.264 . . . . 0.0 114.699 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -66.76 -39.85 88.04 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.705 0.802 . . . . 0.0 112.862 169.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 12' ' ' TRP . 0.5 OUTLIER -64.63 157.81 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 126.887 2.075 . . . . 0.0 111.157 178.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.34 31.42 4.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.889 1.233 . . . . 0.0 113.655 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.499 ' H ' HG13 ' A' ' 10' ' ' VAL . 77.0 t90 -82.74 149.26 27.38 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.547 -0.972 . . . . 0.0 112.334 -178.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -136.61 143.36 42.72 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.0 8.93 1.21 Allowed 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.868 4.378 . . . . 0.0 115.423 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.59 -19.04 6.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.634 1.573 . . . . 0.0 114.189 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.8 p -137.98 -31.63 0.77 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.519 1.128 . . . . 0.0 113.357 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 107.72 -160.49 13.95 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.945 1.26 . . . . 0.0 114.253 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -62.54 151.92 36.26 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.842 0.821 . . . . 0.0 111.436 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -91.67 74.48 5.83 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.822 0.849 . . . . 0.0 112.173 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -49.18 -40.93 35.11 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.675 1.19 . . . . 0.0 114.102 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -56.31 -24.46 43.53 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.507 1.523 . . . . 0.0 114.115 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -140.48 23.39 2.32 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.504 1.521 . . . . 0.0 112.555 -175.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -59.97 149.5 31.78 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.278 1.037 . . . . 0.0 112.226 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.06 158.54 44.24 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 125.298 1.439 . . . . 0.0 113.435 -178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.02 -12.79 36.32 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 123.83 3.02 . . . . 0.0 113.842 -177.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -108.51 -26.34 10.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.718 1.207 . . . . 0.0 112.659 178.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.04 -66.58 0.56 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.067 0.947 . . . . 0.0 110.801 -164.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -30.9 63.01 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.824 173.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -47.09 69.58 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.15 0.98 . . . . 0.0 110.964 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HD22 ' C' ' 140' ' ' LEU . 24.5 tp -61.0 -44.96 96.65 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.341 1.056 . . . . 0.0 112.021 168.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -57.84 -42.95 85.46 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 118.781 0.718 . . . . 0.0 111.173 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.6 -18.15 62.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.134 0.974 . . . . 0.0 113.435 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 7.4 tpp -85.3 -56.92 3.29 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.986 1.314 . . . . 0.0 111.712 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 20.4 t -69.31 -23.48 63.8 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.116 0.871 . . . . 0.0 112.434 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.21 6.07 16.31 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.34 0.971 . . . . 0.0 115.082 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.464 HD11 HD21 ' C' ' 140' ' ' LEU . 3.2 mt -63.76 142.62 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 111.599 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -102.87 154.82 18.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.326 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -49.85 -30.52 10.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.575 1.15 . . . . 0.0 113.075 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.81 -48.51 79.52 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -66.17 -39.0 89.41 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.415 0.686 . . . . 0.0 110.947 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -24.73 67.61 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 125.241 1.416 . . . . 0.0 113.939 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.42 -0.08 55.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.771 1.228 . . . . 0.0 112.884 173.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.94 112.12 22.94 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.536 1.134 . . . . 0.0 109.844 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -13.94 18.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.862 -1.149 . . . . 0.0 114.056 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -99.04 -19.22 17.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.193 1.397 . . . . 0.0 112.705 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.484 HG23 HG23 ' C' ' 149' ' ' ILE . 21.0 m -109.31 -52.15 2.8 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.081 0.952 . . . . 0.0 111.649 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.1 p -53.34 -35.79 60.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.907 1.283 . . . . 0.0 113.393 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -52.73 -49.81 64.68 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.449 1.099 . . . . 0.0 112.802 170.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.37 -43.3 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.799 0.84 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.65 -38.25 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 O-C-N 122.015 -0.428 . . . . 0.0 110.423 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -67.5 -44.74 77.74 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 112.948 172.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -57.92 -28.05 63.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.385 -0.822 . . . . 0.0 113.039 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.76 -49.5 70.5 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.28 0.632 . . . . 0.0 111.77 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.87 -38.6 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 O-C-N 121.162 -0.961 . . . . 0.0 110.959 -179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -63.02 -17.45 62.23 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.7 pttt -122.2 -17.76 7.06 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.5 m -145.28 -31.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -167.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.28 -100.58 0.14 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 118.507 -1.163 . . . . 0.0 110.413 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.9 123.81 0.01 OUTLIER Glycine 0 CA--C 1.535 1.339 0 C-N-CA 126.682 2.087 . . . . 0.0 115.281 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.7 p -56.23 -34.84 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.35 -1.088 . . . . 0.0 113.842 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -84.19 -30.89 25.42 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.193 -0.942 . . . . 0.0 113.176 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -66.25 -44.25 84.22 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.888 1.275 . . . . 0.0 112.762 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.5 -28.64 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.027 0.931 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -24.79 67.54 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 173.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 125.288 1.435 . . . . 0.0 112.434 -176.283 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -147.3 34.01 0.88 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.692 1.197 . . . . 0.0 112.789 -170.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -114.97 122.63 46.85 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.103 1.361 . . . . 0.0 110.191 -177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 86.2 mtp 50.18 35.77 11.02 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 123.402 1.573 . . . . 0.0 114.579 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -101.23 37.56 1.75 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.913 2.485 . . . . 0.0 111.951 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.26 179.54 0.1 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.413 1.485 . . . . 0.0 111.165 165.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -50.81 133.54 26.22 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.757 -0.59 . . . . 0.0 111.022 172.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mtmm -126.47 163.54 23.11 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.912 0.885 . . . . 0.0 110.901 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 30.9 m -138.4 146.77 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.708 1.203 . . . . 0.0 110.587 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -95.19 128.73 42.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 168.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 29.6 p -74.79 127.72 33.85 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 172.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.42 -2.17 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 120.293 -1.505 . . . . 0.0 112.196 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -152.13 157.55 34.01 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 126.337 1.855 . . . . 0.0 111.416 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -71.59 161.73 44.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.621 2.881 . . . . 0.0 113.012 176.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -143.82 150.2 38.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.216 1.406 . . . . 0.0 110.802 170.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 53.0 m -137.55 111.59 8.39 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.336 1.455 . . . . 0.0 110.017 -173.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.7 -39.4 65.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.572 1.549 . . . . 0.0 115.036 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.07 69.42 1.37 Allowed Glycine 0 CA--C 1.535 1.337 0 O-C-N 121.295 -0.878 . . . . 0.0 112.809 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 16.2 m 63.0 27.73 16.01 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.518 1.527 . . . . 0.0 115.048 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -112.16 152.89 27.81 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.121 1.369 . . . . 0.0 112.313 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.14 -2.71 14.88 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.82 1.648 . . . . 0.0 114.082 -175.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 25.9 p -113.81 10.08 17.73 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.693 1.597 . . . . 0.0 111.771 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 23.2 mt -112.58 158.85 19.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.832 1.253 . . . . 0.0 112.072 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.5 tp -120.22 114.99 22.73 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.941 1.297 . . . . 0.0 110.585 -178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 49.6 m -93.85 148.89 21.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.173 0.989 . . . . 0.0 112.026 176.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -164.61 178.14 7.55 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.576 1.55 . . . . 0.0 111.881 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.41 -177.24 3.29 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 170.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 18.1 tm0? -68.95 145.84 53.28 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.0 -1.062 . . . . 0.0 110.691 163.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.47 6.08 87.91 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.465 1.031 . . . . 0.0 113.682 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -87.4 166.02 15.14 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.895 1.278 . . . . 0.0 112.279 176.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 60.7 t -130.3 131.45 65.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 110.669 -170.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mm -128.99 143.13 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.375 1.47 . . . . 0.0 109.717 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.0 m -109.44 116.94 32.75 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 109.268 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.54 142.11 58.23 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.266 0.939 . . . . 0.0 111.269 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 92.7 mt -120.3 1.14 10.73 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.02 1.328 . . . . 0.0 112.683 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 pt -129.51 154.7 80.84 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.865 1.666 . . . . 0.0 110.776 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -76.09 -25.58 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.586 2.857 . . . . 0.0 115.062 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -154.69 163.25 40.52 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.271 1.429 . . . . 0.0 112.225 -175.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.402 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.9 OUTLIER -74.75 166.42 23.63 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 176.003 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.19 121.83 13.39 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.19 174.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.5 t0 51.99 24.34 2.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.33 -1.482 . . . . 0.0 114.825 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.25 -5.57 76.33 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 125.59 1.567 . . . . 0.0 115.958 -173.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.471 ' C ' HD22 ' B' ' 109' ' ' LEU . 97.5 m95 -86.64 134.49 33.61 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.442 1.897 . . . . 0.0 111.923 172.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.471 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.5 mm? -121.55 151.78 39.95 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.86 2.064 . . . . 0.0 109.289 175.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -121.42 135.0 55.11 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.76 0.79 . . . . 0.0 110.64 -175.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -166.05 -175.38 36.4 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 115.338 -0.846 . . . . 0.0 114.224 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -123.52 129.67 51.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.023 1.729 . . . . 0.0 111.033 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -68.0 130.55 43.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.762 0.825 . . . . 0.0 112.918 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -77.54 11.17 2.15 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 115.394 1.628 . . . . 0.0 115.394 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.6 m -123.85 -21.12 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -139.26 -12.63 1.2 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.203 1.401 . . . . 0.0 113.117 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp 65.45 16.59 10.6 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.296 1.838 . . . . 0.0 113.511 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.19 135.29 54.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.22 1.408 . . . . 0.0 110.78 170.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -119.87 149.8 41.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.473 1.509 . . . . 0.0 111.339 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 168.03 166.6 27.37 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 124.085 0.85 . . . . 0.0 111.761 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -73.12 134.72 44.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -129.93 154.09 81.09 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.006 1.322 . . . . 0.0 112.325 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.17 118.87 5.91 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.628 2.885 . . . . 0.0 112.728 175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -35.6 71.54 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.602 -0.686 . . . . 0.0 112.683 173.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.19 -29.48 69.83 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -81.92 9.09 8.82 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.988 1.315 . . . . 0.0 113.665 171.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 13.6 p -134.99 171.62 14.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.606 1.562 . . . . 0.0 111.736 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -132.55 -86.79 0.45 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.257 0.623 . . . . 0.0 112.143 173.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 pp -166.22 173.62 9.98 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 126.246 1.819 . . . . 0.0 111.645 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -134.32 18.88 3.68 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.707 1.603 . . . . 0.0 112.584 173.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.23 155.87 19.92 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.075 0.95 . . . . 0.0 111.908 166.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.871 2.068 . . . . 0.0 114.445 -173.336 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 117.33 -1.319 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -67.27 -32.84 32.25 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.977 1.785 . . . . 0.0 113.659 -163.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.09 -31.47 61.2 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 83.4 t -63.75 -36.55 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.855 0.862 . . . . 0.0 110.843 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.09 -31.08 71.73 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.645 -1.285 . . . . 0.0 113.605 174.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -13.55 61.04 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.438 1.017 . . . . 0.0 112.857 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -107.81 -23.97 11.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.837 2.055 . . . . 0.0 113.168 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.464 HD21 HD11 ' A' ' 36' ' ' ILE . 60.4 tp -60.74 -48.68 80.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.009 0.822 . . . . 0.0 111.654 170.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 39.6 mtt -58.77 -34.62 71.64 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.17 0.441 . . . . 0.0 112.03 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -65.68 -37.06 85.43 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.515 1.126 . . . . 0.0 112.909 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -68.06 -49.74 59.44 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.845 0.748 . . . . 0.0 112.172 173.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.52 -30.02 70.98 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.031 0.532 . . . . 0.0 112.321 -174.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -22.38 65.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.793 1.237 . . . . 0.0 113.229 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -77.54 -21.26 52.89 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.525 1.53 . . . . 0.0 112.274 -177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.08 -1.04 13.13 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.076 1.75 . . . . 0.0 112.257 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 66.46 16.96 65.93 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.029 1.299 . . . . 0.0 114.906 -172.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.484 HG23 HG23 ' A' ' 46' ' ' THR . 33.2 mm -67.23 151.09 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.828 1.314 . . . . 0.0 109.849 169.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -141.32 154.22 67.05 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.385 1.474 . . . . 0.0 111.644 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.41 154.62 73.32 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 123.163 2.575 . . . . 0.0 111.089 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.68 -23.26 66.11 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -52.66 -24.79 9.2 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 171.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -74.04 -12.46 60.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.816 1.646 . . . . 0.0 114.002 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 2.1 ptm -152.59 52.11 0.77 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.473 1.509 . . . . 0.0 112.22 -165.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -146.09 174.18 11.53 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.331 1.453 . . . . 0.0 112.954 -175.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -118.93 160.37 22.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.774 1.23 . . . . 0.0 113.34 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -72.35 174.34 7.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.703 2.001 . . . . 0.0 112.877 169.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 mm -123.87 134.84 25.65 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 125.209 1.404 . . . . 0.0 110.154 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.16 173.86 8.86 Favored 'Trans proline' 0 CA--C 1.549 1.268 1 C-N-CA 125.91 4.406 . . . . 0.0 114.01 177.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.8 -77.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 123.614 2.876 . . . . 0.0 113.998 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.29 162.9 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 129.14 2.976 . . . . 0.0 112.779 -172.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 93.1 Cg_endo -71.89 171.05 17.36 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.289 3.326 . . . . 0.0 113.838 173.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -80.7 -8.74 59.75 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.155 1.382 . . . . 0.0 114.614 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.6 p90 -128.85 159.51 68.04 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.621 1.568 . . . . 0.0 111.978 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.28 157.35 57.24 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 122.841 2.361 . . . . 0.0 114.097 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.05 135.29 96.29 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.41 169.04 17.93 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.766 2.978 . . . . 0.0 113.718 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.4 p -130.78 149.96 75.1 Favored Pre-proline 0 N--CA 1.477 0.902 0 C-N-CA 125.566 1.546 . . . . 0.0 112.739 -173.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.97 167.23 22.17 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 124.742 3.628 . . . . 0.0 113.171 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -68.76 78.17 0.72 Allowed 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.707 3.605 . . . . 0.0 112.19 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 55.0 t -138.79 142.63 33.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.678 1.591 . . . . 0.0 109.416 -177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -146.45 -178.64 6.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.572 1.549 . . . . 0.0 111.636 -178.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -55.53 144.23 26.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.903 0.881 . . . . 0.0 112.198 175.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 53.28 43.46 31.45 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -170.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -54.09 149.6 9.22 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.662 1.185 . . . . 0.0 114.024 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 78.7 p -159.61 160.94 34.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.239 1.416 . . . . 0.0 111.964 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -147.57 71.27 11.67 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 125.05 1.34 . . . . 0.0 111.304 174.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 C--O 1.255 1.369 0 C-N-CA 123.61 2.874 . . . . 0.0 112.944 176.838 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.2 m 51.22 34.76 11.97 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.043 1.737 . . . . 0.0 115.197 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -67.12 -21.11 65.86 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.664 1.186 . . . . 0.0 114.0 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -142.55 174.25 10.8 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.302 1.841 . . . . 0.0 111.61 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -119.62 -61.9 1.56 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.234 1.413 . . . . 0.0 112.646 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -16.8 64.5 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.2 pt -142.29 -177.17 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 127.941 2.496 . . . . 0.0 109.67 -176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 132.98 -24.63 3.79 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.496 1.046 . . . . 0.0 112.086 171.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -63.59 -46.77 84.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.022 1.729 . . . . 0.0 114.226 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.66 156.69 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 124.93 1.292 . . . . 0.0 111.726 -176.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.04 31.72 4.41 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.067 1.318 . . . . 0.0 114.442 -175.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -77.71 149.22 34.61 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.58 -0.953 . . . . 0.0 112.583 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -135.29 142.66 42.4 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.02 4.13 2.93 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.521 4.148 . . . . 0.0 115.326 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -113.59 -27.59 7.8 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.996 1.318 . . . . 0.0 113.617 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.4 p -135.47 -31.47 0.96 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.447 1.099 . . . . 0.0 113.355 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.31 -159.72 13.56 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.986 1.279 . . . . 0.0 114.489 175.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CD1' HD22 ' A' ' 41' ' ' LEU . 78.9 m-85 -60.24 156.4 15.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.178 0.989 . . . . 0.0 112.344 176.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.03 61.64 6.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.666 0.787 . . . . 0.0 112.047 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -45.85 -39.12 8.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.472 1.509 . . . . 0.0 113.74 -177.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -53.52 -31.94 48.36 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.876 1.671 . . . . 0.0 114.321 177.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.22 31.33 1.01 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.684 1.594 . . . . 0.0 111.917 -172.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mt -57.32 153.15 12.78 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.311 1.045 . . . . 0.0 112.866 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.37 155.35 48.17 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.861 1.264 . . . . 0.0 113.325 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -66.6 -12.77 37.18 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.944 3.096 . . . . 0.0 113.943 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -111.92 -18.21 12.72 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 112.863 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -71.19 -67.53 0.51 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.427 1.091 . . . . 0.0 110.912 -171.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -30.63 62.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.624 0.77 . . . . 0.0 112.494 173.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -65.98 -43.54 87.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.679 1.192 . . . . 0.0 110.368 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.445 HD21 HD22 ' C' ' 140' ' ' LEU . 15.5 tp -68.57 -42.71 77.93 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.491 1.117 . . . . 0.0 111.712 172.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -56.65 -46.27 81.14 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.817 -0.552 . . . . 0.0 110.807 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.31 -9.01 57.93 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.547 1.139 . . . . 0.0 113.671 175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 6.7 tpp -91.25 -56.86 2.99 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.064 1.346 . . . . 0.0 111.233 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -28.02 64.63 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.956 0.798 . . . . 0.0 112.756 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.8 10.64 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 125.356 1.455 . . . . 0.0 114.778 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.506 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -60.5 144.83 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.693 1.197 . . . . 0.0 110.634 176.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -127.19 162.73 25.47 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.854 0.862 . . . . 0.0 110.525 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.41 -28.83 46.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -175.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.44 76.48 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -77.61 -34.86 53.29 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.171 0.988 . . . . 0.0 111.058 174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 18' ' ' PHE . 61.7 mt -70.85 -23.19 62.28 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.219 1.408 . . . . 0.0 112.914 178.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -94.19 -3.73 50.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.16 1.784 . . . . 0.0 112.905 171.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -84.34 109.78 18.1 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.471 1.108 . . . . 0.0 109.666 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.424 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -59.61 -14.04 11.91 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 120.624 -1.297 . . . . 0.0 113.711 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -100.48 -22.5 14.99 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.161 1.384 . . . . 0.0 113.256 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.46 HG23 HG23 ' C' ' 149' ' ' ILE . 48.3 m -103.18 -50.84 3.38 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.03 0.932 . . . . 0.0 111.529 175.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 p -53.18 -36.56 61.04 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.864 1.266 . . . . 0.0 113.544 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -53.09 -49.13 67.05 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 112.432 170.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.54 -43.81 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.801 0.84 . . . . 0.0 110.881 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 40.2 mt -62.36 -39.39 84.05 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 122.046 -0.409 . . . . 0.0 110.073 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -67.89 -43.35 79.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.056 -1.027 . . . . 0.0 112.965 174.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -55.42 -31.82 62.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.665 0.666 . . . . 0.0 112.276 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' C' ' 140' ' ' LEU . 33.9 t80 -65.78 -49.13 69.45 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.602 0.761 . . . . 0.0 112.292 170.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -62.51 -37.73 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 O-C-N 120.469 -1.395 . . . . 0.0 110.897 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -65.19 -12.92 56.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.361 1.064 . . . . 0.0 113.757 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -11.3 4.44 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -173.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 m -152.18 -27.76 0.17 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.01 1.324 . . . . 0.0 113.337 -169.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -76.43 -110.89 0.13 Allowed Glycine 0 C--N 1.338 0.688 0 CA-C-O 118.199 -1.334 . . . . 0.0 110.413 166.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.04 124.45 0.02 OUTLIER Glycine 0 CA--C 1.537 1.469 0 C-N-CA 126.428 1.966 . . . . 0.0 114.056 -173.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.0 p -55.56 -35.26 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 121.046 -1.267 . . . . 0.0 114.217 -175.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -87.85 -30.9 19.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.181 0.992 . . . . 0.0 113.375 176.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -63.47 -34.28 77.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.195 1.398 . . . . 0.0 113.292 177.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.0 t -75.79 -30.03 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.519 0.727 . . . . 0.0 111.685 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.79 -31.6 71.59 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 169.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.1 t30 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 124.814 1.246 . . . . 0.0 113.329 -175.182 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.074 -0.41 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 34.5 t -152.19 152.06 31.77 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.954 1.301 . . . . 0.0 111.986 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -94.93 -4.2 47.23 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.295 1.438 . . . . 0.0 113.404 173.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 43.0 mtp -77.59 178.58 7.16 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.659 1.184 . . . . 0.0 112.495 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.27 167.71 2.33 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.109 1.364 . . . . 0.0 113.771 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.54 10.05 35.2 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 126.546 1.938 . . . . 0.0 114.991 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -122.78 15.21 10.12 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.562 1.545 . . . . 0.0 115.127 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -62.61 167.42 4.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.843 0.857 . . . . 0.0 112.619 -170.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 m -140.66 150.42 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.023 177.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -103.57 128.56 50.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 10.5 p -69.1 145.61 53.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -119.53 -1.38 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 O-C-N 120.655 -1.278 . . . . 0.0 112.051 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -152.7 154.96 32.17 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.043 1.737 . . . . 0.0 111.048 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -72.6 161.97 42.59 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.956 3.104 . . . . 0.0 112.917 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -141.05 136.16 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.559 1.144 . . . . 0.0 111.558 173.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 39.6 m -106.27 98.0 7.74 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.531 1.532 . . . . 0.0 110.312 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.17 66.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.017 1.327 . . . . 0.0 114.245 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.42 49.58 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.378 -0.826 . . . . 0.0 113.39 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 77.6 p -75.87 -0.58 21.8 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.85 166.83 10.47 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' B' ' 86' ' ' LYS . 0.0 OUTLIER -120.45 0.65 10.57 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.344 1.458 . . . . 0.0 114.335 -176.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.9 p -127.98 7.68 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.1 1.76 . . . . 0.0 112.817 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.82 157.74 16.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.278 1.031 . . . . 0.0 113.031 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.6 tp -118.35 114.72 23.36 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 110.226 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -92.88 151.07 20.18 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.85 0.86 . . . . 0.0 112.269 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -165.65 178.2 6.81 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.448 1.499 . . . . 0.0 111.659 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.26 -178.27 3.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.756 1.622 . . . . 0.0 111.213 169.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -65.57 146.11 55.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.049 0.939 . . . . 0.0 111.24 164.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.56 3.63 90.13 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.195 0.902 . . . . 0.0 113.857 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.5 166.48 21.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.927 1.291 . . . . 0.0 112.102 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -132.52 139.58 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 120.809 -1.182 . . . . 0.0 110.623 -170.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 6.0 mm -141.44 139.07 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.614 1.166 . . . . 0.0 109.253 -167.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.3 114.91 29.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.127 1.371 . . . . 0.0 109.34 178.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.85 145.23 46.37 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.308 0.575 . . . . 0.0 110.948 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -120.95 2.16 10.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.245 1.418 . . . . 0.0 112.209 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.5 pt -130.2 155.75 80.36 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.908 1.683 . . . . 0.0 110.951 -174.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -25.54 9.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.554 2.836 . . . . 0.0 114.956 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -154.47 161.43 41.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.27 1.428 . . . . 0.0 112.347 -175.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.47 167.02 22.54 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 122.57 13.16 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.344 174.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t0 52.06 24.49 2.7 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.34 -1.475 . . . . 0.0 114.776 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.24 -5.48 76.77 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 125.554 1.549 . . . . 0.0 115.802 -173.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.476 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.5 m95 -87.35 134.47 33.57 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.491 1.916 . . . . 0.0 112.016 173.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.476 HD22 ' C ' ' B' ' 108' ' ' TRP . 3.6 mm? -121.86 148.61 44.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.512 1.925 . . . . 0.0 109.531 175.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -116.01 136.5 52.97 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.692 -0.63 . . . . 0.0 110.478 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.47 -179.68 40.43 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.8 -0.636 . . . . 0.0 114.011 -174.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -122.49 129.89 52.48 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 110.378 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.405 ' CE1' HG22 ' B' ' 115' ' ' VAL . 3.2 t-80 -72.47 136.42 45.96 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -76.57 8.13 3.85 Favored 'General case' 0 CA--C 1.558 1.26 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.405 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.5 m -127.71 -13.1 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -176.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -147.38 -10.14 0.42 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.915 1.286 . . . . 0.0 113.074 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp 60.26 17.34 6.92 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.185 1.794 . . . . 0.0 113.894 -174.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.02 137.98 57.47 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.696 0.798 . . . . 0.0 110.848 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.1 mtt-85 -119.06 144.05 46.78 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.584 1.554 . . . . 0.0 109.877 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 169.1 167.2 29.37 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-O 121.177 0.321 . . . . 0.0 112.604 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -72.6 132.38 43.69 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 171.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -128.51 154.09 79.39 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 111.998 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.41 115.85 4.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.684 2.923 . . . . 0.0 112.756 175.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' HD23 ' B' ' 109' ' ' LEU . 3.6 t -58.58 -30.16 66.96 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.6 -0.688 . . . . 0.0 112.613 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 18.7 m -62.19 -28.47 69.69 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.948 -1.095 . . . . 0.0 113.929 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -87.91 7.23 31.82 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.097 1.359 . . . . 0.0 113.916 171.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 p -131.07 -171.91 2.7 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.524 1.53 . . . . 0.0 110.552 174.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.441 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 0.3 OUTLIER -150.3 -88.23 0.07 Allowed 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.221 -0.924 . . . . 0.0 112.544 177.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 0.0 OUTLIER -153.3 -175.23 5.25 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.784 2.433 . . . . 0.0 110.436 178.497 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.8 mt -133.19 19.33 4.04 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 169.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -57.3 158.13 5.75 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.81 2.044 . . . . 0.0 115.911 -168.891 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 117.227 -1.368 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -33.22 22.33 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.874 1.716 . . . . 0.0 113.48 -167.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.77 -30.68 61.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.311 0.644 . . . . 0.0 112.491 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.9 t -64.47 -36.8 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.932 0.893 . . . . 0.0 111.187 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.59 -29.21 69.22 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.69 -1.257 . . . . 0.0 113.542 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.27 -25.36 65.13 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -101.38 -23.68 14.32 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.053 2.141 . . . . 0.0 113.135 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 36' ' ' ILE . 65.4 tp -61.87 -47.92 82.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.834 0.743 . . . . 0.0 111.698 171.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.06 -34.44 71.95 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.71 -39.5 93.76 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.114 0.966 . . . . 0.0 112.414 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -66.16 -49.14 68.42 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 118.848 0.749 . . . . 0.0 112.3 174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.89 -29.08 70.49 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.754 -0.591 . . . . 0.0 112.415 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -68.38 -20.93 64.72 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.736 1.214 . . . . 0.0 113.056 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -78.24 -20.81 50.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.285 1.434 . . . . 0.0 112.44 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -116.09 -1.33 12.48 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.906 1.682 . . . . 0.0 112.394 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 64.53 20.8 66.2 Favored Glycine 0 CA--C 1.538 1.475 0 C-N-CA 124.723 1.154 . . . . 0.0 114.769 -172.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.46 HG23 HG23 ' A' ' 46' ' ' THR . 32.8 mm -65.45 151.29 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 119.208 1.504 . . . . 0.0 109.88 168.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -134.1 151.16 76.1 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 124.907 1.283 . . . . 0.0 111.58 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.19 156.99 62.15 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.652 2.234 . . . . 0.0 111.258 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.5 -18.92 65.63 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 43.0 ptt85 -62.67 -12.33 22.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.875 1.27 . . . . 0.0 114.302 168.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 31.0 m120 -131.15 70.97 1.46 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.681 1.992 . . . . 0.0 110.868 -176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 14.3 mtp -128.13 107.04 9.48 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.877 1.271 . . . . 0.0 111.706 -177.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.24 152.04 21.81 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.802 1.241 . . . . 0.0 112.225 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -163.27 166.44 23.14 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.382 1.473 . . . . 0.0 113.443 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -87.68 176.63 7.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.603 1.961 . . . . 0.0 112.711 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.7 mm -121.62 134.78 24.7 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.189 1.396 . . . . 0.0 110.251 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -66.83 173.65 7.82 Favored 'Trans proline' 0 CA--C 1.551 1.354 1 C-N-CA 125.94 4.427 . . . . 0.0 114.289 177.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.99 -78.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.771 2.981 . . . . 0.0 113.703 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.486 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 153.82 163.67 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 129.007 2.923 . . . . 0.0 112.905 -172.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 97.0 Cg_endo -71.97 172.67 14.17 Favored 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 124.257 3.305 . . . . 0.0 113.637 172.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -89.26 5.74 43.51 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.331 1.453 . . . . 0.0 114.628 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -137.45 158.85 71.35 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 125.436 1.494 . . . . 0.0 111.502 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.68 158.81 52.59 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.83 2.353 . . . . 0.0 114.029 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.1 133.89 95.6 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.4 166.53 26.84 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.003 3.135 . . . . 0.0 112.828 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -128.31 150.39 74.03 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 125.145 1.378 . . . . 0.0 113.164 -171.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.15 165.86 27.03 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 124.619 3.546 . . . . 0.0 113.599 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.02 79.49 1.02 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.585 3.523 . . . . 0.0 111.899 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 58.3 t -137.87 106.25 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 125.127 1.371 . . . . 0.0 109.267 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -151.78 -159.34 1.01 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.968 1.707 . . . . 0.0 110.462 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.99 99.71 0.37 Allowed 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.018 -1.052 . . . . 0.0 111.445 171.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -112.37 158.72 19.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.179 1.791 . . . . 0.0 111.567 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.89 -33.73 62.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.714 0.805 . . . . 0.0 112.911 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 89.5 p 42.76 32.1 0.36 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.949 2.499 . . . . 0.0 116.47 -176.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 62.31 149.71 0.1 OUTLIER Pre-proline 0 N--CA 1.486 1.336 0 C-N-CA 128.949 2.899 . . . . 0.0 114.632 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo . . . . . 0 C--O 1.254 1.305 0 C-N-CA 123.7 2.934 . . . . 0.0 113.191 177.906 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -149.01 54.48 0.98 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.688 1.595 . . . . 0.0 111.449 -174.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -134.82 170.59 15.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.211 1.805 . . . . 0.0 112.716 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -66.78 166.09 13.86 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -110.68 -68.35 0.93 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.46 1.504 . . . . 0.0 112.437 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -14.6 63.13 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 pt -141.07 -167.67 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 127.475 2.31 . . . . 0.0 109.271 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.01 -33.76 2.87 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.15 1.357 . . . . 0.0 110.706 171.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -57.5 -25.72 60.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.49 2.316 . . . . 0.0 115.315 172.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.7 t -78.55 -36.17 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.945 0.898 . . . . 0.0 113.417 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.96 26.99 63.93 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.957 1.265 . . . . 0.0 116.043 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -79.51 148.86 31.66 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.694 1.247 . . . . 0.0 112.039 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -136.22 143.86 45.53 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.16 5.62 2.16 Favored 'Trans proline' 0 C--N 1.355 0.887 1 C-N-CA 125.666 4.244 . . . . 0.0 115.44 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -120.65 -20.96 6.88 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.457 1.503 . . . . 0.0 113.769 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.9 p -136.16 -33.31 0.83 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.304 1.042 . . . . 0.0 113.457 -174.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.96 -160.02 13.48 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.735 1.16 . . . . 0.0 115.092 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -64.73 146.74 54.34 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.672 0.789 . . . . 0.0 112.138 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.49 67.47 9.93 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 122.834 1.302 . . . . 0.0 113.267 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.4 mt -46.07 -36.68 5.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.836 2.455 . . . . 0.0 114.17 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -53.63 -32.77 52.7 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.446 1.498 . . . . 0.0 113.476 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -147.53 33.08 0.87 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.464 1.505 . . . . 0.0 112.076 -175.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 mt -57.3 152.43 14.08 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.965 0.888 . . . . 0.0 111.867 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.02 158.16 27.37 Favored Pre-proline 0 N--CA 1.472 0.661 0 C-N-CA 125.044 1.338 . . . . 0.0 113.024 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -65.17 -10.11 24.49 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.74 2.96 . . . . 0.0 114.041 178.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -107.46 -30.02 8.89 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.891 1.277 . . . . 0.0 113.118 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.88 -61.22 2.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.235 -0.916 . . . . 0.0 111.377 -162.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.96 -32.92 68.3 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.094 -0.957 . . . . 0.0 113.233 172.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -66.75 -43.51 83.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 122.749 0.419 . . . . 0.0 110.633 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 HD22 ' C' ' 140' ' ' LEU . 1.3 tm? -63.58 -44.64 93.48 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.805 1.242 . . . . 0.0 110.811 172.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -59.48 -46.54 88.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.556 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.13 -24.52 65.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.207 1.003 . . . . 0.0 113.063 177.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.07 -52.69 13.35 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.668 1.187 . . . . 0.0 111.442 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.401 ' HB3' HD12 ' A' ' 36' ' ' ILE . 48.3 t -70.53 -26.53 63.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 122.667 0.387 . . . . 0.0 111.8 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.15 6.83 13.23 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 125.055 1.312 . . . . 0.0 114.933 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 34' ' ' CYS . 3.0 mt -64.46 148.76 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.859 1.664 . . . . 0.0 109.998 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.3 t -127.23 161.22 29.06 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.584 0.754 . . . . 0.0 111.259 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -51.9 -30.26 23.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.191 1.396 . . . . 0.0 113.742 -176.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.92 -44.02 70.26 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 172.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -71.1 -41.23 70.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.726 0.81 . . . . 0.0 110.936 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -24.46 66.31 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.952 1.301 . . . . 0.0 113.734 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -92.91 -4.14 53.31 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.386 1.474 . . . . 0.0 112.819 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -85.6 111.93 20.5 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.718 1.207 . . . . 0.0 109.581 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -14.0 14.94 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -102.45 -21.93 14.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.467 1.507 . . . . 0.0 112.835 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.502 HG23 HG23 ' C' ' 149' ' ' ILE . 25.1 m -103.47 -51.47 3.2 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.861 0.864 . . . . 0.0 111.133 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.5 p -53.25 -37.22 61.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.833 1.253 . . . . 0.0 113.381 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -51.93 -48.66 64.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.016 1.326 . . . . 0.0 112.772 172.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.04 -44.42 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.673 0.789 . . . . 0.0 110.844 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.3 mt -61.44 -39.38 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-O 120.908 0.385 . . . . 0.0 110.2 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -66.95 -44.05 81.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.918 1.287 . . . . 0.0 113.274 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.16 -30.73 62.61 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -66.43 -49.77 65.61 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.53 0.732 . . . . 0.0 112.162 171.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.4 mt -63.73 -38.76 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 120.377 -1.452 . . . . 0.0 111.547 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -69.94 -7.8 43.57 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.01 -15.89 5.22 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 m -147.14 -29.99 0.35 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.037 1.335 . . . . 0.0 113.3 -168.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -78.14 -103.24 0.19 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-O 118.4 -1.222 . . . . 0.0 110.939 173.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.79 128.63 0.02 OUTLIER Glycine 0 CA--C 1.54 1.624 0 C-N-CA 126.5 2.0 . . . . 0.0 114.914 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.78 -34.83 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -91.01 -32.7 15.82 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.624 1.17 . . . . 0.0 113.326 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -61.31 -40.02 92.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.232 1.413 . . . . 0.0 113.485 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 88.7 t -73.08 -32.29 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 123.856 0.863 . . . . 0.0 111.343 177.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.95 -25.58 63.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.202 1.801 . . . . 0.0 114.122 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 124.93 1.292 . . . . 0.0 112.813 174.121 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 76.3 p -146.01 150.15 35.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.786 1.234 . . . . 0.0 112.461 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -71.97 -42.1 66.92 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.168 0.587 . . . . 0.0 111.5 170.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 65.9 mtp -82.8 166.61 18.86 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.583 1.153 . . . . 0.0 111.908 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -49.06 146.53 3.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.974 1.709 . . . . 0.0 113.672 174.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.84 58.91 4.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.692 1.597 . . . . 0.0 112.018 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -146.53 112.78 5.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.898 1.279 . . . . 0.0 110.71 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -138.83 167.32 22.26 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.668 1.187 . . . . 0.0 111.507 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -135.89 154.66 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.625 1.57 . . . . 0.0 110.633 173.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -102.7 126.59 49.85 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 163.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.6 p -72.14 136.22 46.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.79 -1.45 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.686 1.194 . . . . 0.0 111.826 -178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -154.43 156.94 32.14 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.06 1.744 . . . . 0.0 111.106 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.78 163.77 37.5 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.455 2.77 . . . . 0.0 112.93 174.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -147.58 151.01 35.56 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.798 1.639 . . . . 0.0 110.344 172.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 55.7 m -136.22 123.21 21.47 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.291 1.437 . . . . 0.0 109.81 -173.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -56.97 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -172.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.0 93.12 0.05 OUTLIER Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.322 0.963 . . . . 0.0 113.778 -178.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . 0.257 94.2 p 49.33 37.88 12.56 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.632 1.973 . . . . 0.0 115.997 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -122.73 157.63 31.91 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.93 1.692 . . . . 0.0 111.449 174.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -123.82 13.76 9.25 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.863 1.665 . . . . 0.0 112.801 177.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 30.0 p -128.55 9.74 6.05 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.762 2.025 . . . . 0.0 112.416 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.69 159.38 18.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.089 1.356 . . . . 0.0 111.833 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 46.9 tp -120.5 132.52 55.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.428 1.491 . . . . 0.0 110.149 -177.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.4 t -119.26 147.96 43.67 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.377 1.471 . . . . 0.0 111.301 -177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -169.74 -178.22 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.871 2.068 . . . . 0.0 111.632 -168.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -121.86 166.63 14.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.02 1.728 . . . . 0.0 111.399 173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 16.0 tm0? -54.17 137.71 40.02 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.023 -1.048 . . . . 0.0 111.682 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.96 -3.31 77.13 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.489 1.042 . . . . 0.0 113.943 177.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -79.97 156.46 27.19 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 117.968 0.884 . . . . 0.0 111.941 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 77.1 t -120.84 134.06 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.491 1.516 . . . . 0.0 110.679 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.0 mm -128.0 133.58 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.168 1.387 . . . . 0.0 109.073 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 30.4 m -95.09 129.4 42.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.865 0.866 . . . . 0.0 109.459 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.31 148.77 50.28 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.726 0.774 . . . . 0.0 111.885 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 73.7 mt -122.82 -0.71 9.02 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.843 1.657 . . . . 0.0 112.49 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.8 pt -126.1 154.89 74.17 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.116 1.766 . . . . 0.0 110.269 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.86 -25.8 10.21 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.545 2.83 . . . . 0.0 114.665 -177.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -155.59 159.53 39.72 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.475 1.51 . . . . 0.0 111.796 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.1 pm0 -77.36 171.11 15.38 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.86 120.27 9.02 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.079 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 53.16 25.34 4.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.401 -1.437 . . . . 0.0 114.796 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.07 4.3 83.11 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.606 1.574 . . . . 0.0 116.0 -171.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -90.49 143.11 27.06 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 125.34 1.456 . . . . 0.0 111.037 168.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' B' ' 104' ' ' GLU . 23.0 mt -130.61 151.94 50.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.942 2.097 . . . . 0.0 110.321 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -125.07 133.42 52.92 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.97 0.89 . . . . 0.0 110.734 -176.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.32 -176.22 34.16 Favored Glycine 0 CA--C 1.523 0.579 0 CA-C-N 115.115 -0.948 . . . . 0.0 113.383 -171.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.69 128.83 46.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.55 1.54 . . . . 0.0 109.72 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.429 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -69.62 129.83 40.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.355 1.062 . . . . 0.0 112.508 -179.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -72.16 3.55 4.42 Favored 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -175.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.9 m -127.64 -19.99 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -175.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 45.6 t -130.9 -17.87 3.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.928 1.691 . . . . 0.0 112.343 -171.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 62.91 14.33 7.37 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.717 2.007 . . . . 0.0 113.524 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.16 138.75 57.93 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.302 1.441 . . . . 0.0 110.912 169.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -120.49 153.44 36.64 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.828 1.651 . . . . 0.0 111.773 174.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.77 168.92 27.65 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.574 1.083 . . . . 0.0 112.064 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.79 129.36 38.02 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -119.22 151.31 50.76 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.061 1.344 . . . . 0.0 111.435 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . 0.406 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 66.9 Cg_endo -74.45 119.46 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.342 2.694 . . . . 0.0 113.404 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.471 ' HB2' HD12 ' B' ' 109' ' ' LEU . 40.5 t -55.76 -30.58 61.5 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.572 1.549 . . . . 0.0 113.442 174.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 1.4 m -64.69 -33.89 77.01 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.106 -0.996 . . . . 0.0 113.503 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -86.65 7.25 27.31 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.474 1.51 . . . . 0.0 113.236 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.4 p -132.56 165.95 23.21 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.635 -1.291 . . . . 0.0 112.307 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -140.55 147.56 39.66 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.618 1.167 . . . . 0.0 110.357 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.2 154.73 26.53 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.867 0.841 . . . . 0.0 112.073 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 33.1 mt -108.44 16.8 22.75 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.53 1.532 . . . . 0.0 111.847 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.41 148.96 17.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 167.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.255 1.39 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 177.442 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' C' ' 133' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.159 -1.4 . . . . 0.0 113.858 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.78 -28.95 59.46 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.131 1.887 . . . . 0.0 114.167 -167.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.05 -35.52 69.34 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 75.3 t -61.27 -38.65 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 O-C-N 120.944 -1.098 . . . . 0.0 111.379 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.13 71.24 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.043 -1.036 . . . . 0.0 113.521 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -26.27 64.52 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.013 0.824 . . . . 0.0 112.433 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -96.61 -24.24 16.11 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.379 1.871 . . . . 0.0 112.874 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.579 HD22 HD11 ' A' ' 30' ' ' LEU . 60.0 tp -60.97 -47.16 87.71 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.546 0.612 . . . . 0.0 111.844 171.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 45.0 mtt -57.91 -35.12 70.6 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.563 0.62 . . . . 0.0 112.311 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -65.89 -36.56 83.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.449 1.1 . . . . 0.0 113.064 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.2 t60 -68.82 -48.17 64.24 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.858 0.754 . . . . 0.0 112.099 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.47 -30.56 71.34 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.748 -0.595 . . . . 0.0 112.456 -175.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.75 -22.34 66.05 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.826 1.25 . . . . 0.0 113.209 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -77.85 -20.58 52.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.505 1.522 . . . . 0.0 112.332 -177.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -115.97 -0.69 12.72 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.341 1.856 . . . . 0.0 112.209 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 67.05 15.83 65.66 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.193 1.378 . . . . 0.0 115.101 -172.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.502 HG23 HG23 ' A' ' 46' ' ' THR . 32.2 mm -67.52 152.59 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.809 1.304 . . . . 0.0 110.294 170.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -143.68 156.48 59.62 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 125.93 1.692 . . . . 0.0 111.409 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.83 160.21 49.37 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.864 2.376 . . . . 0.0 111.458 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.3 -22.43 64.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.091 0.957 . . . . 0.0 113.038 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -63.37 -16.51 60.66 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 172.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -98.64 33.18 2.34 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.54 1.536 . . . . 0.0 111.182 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 40.2 mtt -128.34 121.51 29.33 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.357 1.463 . . . . 0.0 110.811 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -161.43 171.24 18.55 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.587 1.555 . . . . 0.0 111.738 -177.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -136.35 154.26 50.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.766 1.226 . . . . 0.0 112.62 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -66.42 168.3 9.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.359 1.464 . . . . 0.0 112.412 168.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 15.3 mm -124.62 133.96 25.2 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.915 1.286 . . . . 0.0 109.796 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -67.49 172.94 9.56 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 C-N-CA 125.618 4.212 . . . . 0.0 113.922 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -67.15 -76.44 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.66 2.907 . . . . 0.0 114.077 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.497 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 152.59 162.28 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 129.347 3.059 . . . . 0.0 112.396 -173.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.497 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 76.5 Cg_endo -71.58 169.82 20.05 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.269 3.313 . . . . 0.0 113.535 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -88.07 8.63 25.78 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.957 1.465 . . . . 0.0 114.957 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 18.8 p90 -136.82 157.54 74.68 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 125.685 1.594 . . . . 0.0 111.181 175.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.82 159.51 52.38 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.369 2.046 . . . . 0.0 113.017 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.58 133.56 88.83 Favored Pre-proline 0 CA--C 1.55 0.963 0 O-C-N 121.947 -0.471 . . . . 0.0 111.617 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 37.7 Cg_endo -64.69 176.09 3.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.139 3.226 . . . . 0.0 112.533 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 21.8 p -130.36 148.91 71.78 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.881 1.272 . . . . 0.0 112.759 -175.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.38 166.44 25.47 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.521 3.48 . . . . 0.0 113.79 -176.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.89 70.1 2.21 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 125.192 3.928 . . . . 0.0 112.336 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.87 142.59 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 108.786 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -138.04 113.67 9.67 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.631 1.173 . . . . 0.0 109.961 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.85 129.86 42.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.952 0.901 . . . . 0.0 111.56 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -155.6 145.69 21.61 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.967 1.307 . . . . 0.0 110.073 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -102.94 142.25 34.36 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.2 1.0 . . . . 0.0 111.845 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 73.5 p -156.15 151.4 26.62 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.693 1.597 . . . . 0.0 111.277 173.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 89.8 mtt-85 36.07 58.78 3.17 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 127.215 2.206 . . . . 0.0 114.76 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 C--O 1.254 1.31 0 C-N-CA 124.072 3.182 . . . . 0.0 113.523 -176.284 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -111.63 7.41 20.46 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.707 1.203 . . . . 0.0 113.239 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -131.42 177.37 7.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.689 1.996 . . . . 0.0 110.728 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.04 168.48 2.43 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -109.83 -51.35 2.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.171 1.788 . . . . 0.0 113.771 -173.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -62.95 -13.98 41.54 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 176.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.545 HG13 ' H ' ' A' ' 8' ' ' GLY . 22.3 pt -118.62 -99.74 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.087 1.355 . . . . 0.0 109.37 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.545 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 68.45 23.43 75.15 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.223 0.916 . . . . 0.0 113.399 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -127.48 -43.85 1.57 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.919 1.688 . . . . 0.0 111.59 -175.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.35 156.39 4.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 125.062 1.345 . . . . 0.0 111.717 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.92 84.7 0.37 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 173.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -135.17 149.79 50.03 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.717 0.807 . . . . 0.0 112.372 172.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -136.65 143.22 42.05 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.661 1.184 . . . . 0.0 114.166 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.19 0.21 6.3 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 124.935 3.757 . . . . 0.0 115.173 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -108.05 -24.46 11.57 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.993 1.317 . . . . 0.0 113.662 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 60.1 p -135.02 -42.98 0.73 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.375 1.07 . . . . 0.0 112.51 -171.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.03 -157.81 15.52 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.856 1.693 . . . . 0.0 113.415 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -64.13 147.57 51.95 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.935 0.874 . . . . 0.0 111.335 174.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -95.3 76.17 3.4 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.564 1.546 . . . . 0.0 111.813 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.508 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.1 mm? -47.1 -41.8 17.9 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.049 1.339 . . . . 0.0 113.728 -175.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -55.59 -24.12 31.12 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.286 1.834 . . . . 0.0 114.469 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -139.59 21.43 2.53 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.624 1.569 . . . . 0.0 112.875 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 23' ' ' LEU . 6.9 mt -61.65 149.85 38.19 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 122.256 1.027 . . . . 0.0 112.863 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.28 158.74 63.19 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.986 1.714 . . . . 0.0 113.97 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.8 -10.99 30.6 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 124.555 3.503 . . . . 0.0 114.291 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -115.95 -16.93 11.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.813 1.245 . . . . 0.0 112.717 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.35 -68.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.886 0.874 . . . . 0.0 110.843 -174.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -31.6 63.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -69.42 -45.76 68.42 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.477 1.111 . . . . 0.0 110.829 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.2 tp -62.36 -43.79 97.99 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.864 0.866 . . . . 0.0 112.148 168.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.498 ' CD2' HD21 ' A' ' 41' ' ' LEU . 21.3 m-85 -56.1 -44.86 79.44 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.908 0.776 . . . . 0.0 110.507 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.6 -20.35 63.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.502 1.121 . . . . 0.0 113.64 173.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.0 tpp -77.41 -60.04 2.53 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.509 1.123 . . . . 0.0 111.265 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HB3' HD12 ' A' ' 36' ' ' ILE . 46.0 t -66.59 -31.83 72.78 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.233 0.47 . . . . 0.0 111.46 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.05 9.7 8.67 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.179 1.371 . . . . 0.0 113.941 177.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' A' ' 34' ' ' CYS . 2.7 mp -63.82 144.24 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 CA-C-N 118.715 1.257 . . . . 0.0 110.363 174.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.6 t -117.62 160.4 21.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.084 0.954 . . . . 0.0 112.111 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.21 -28.39 11.31 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.022 1.729 . . . . 0.0 114.517 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -43.52 98.68 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.61 -39.0 84.76 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.158 0.583 . . . . 0.0 110.715 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' A' ' 31' ' ' PHE . 3.5 mp -62.82 -28.41 69.99 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.025 1.73 . . . . 0.0 113.012 176.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -96.61 3.26 52.67 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.557 1.143 . . . . 0.0 112.88 175.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -89.77 112.28 23.53 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.586 1.154 . . . . 0.0 109.032 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -60.11 -15.26 21.95 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.93 -1.106 . . . . 0.0 113.668 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -97.94 -29.03 13.54 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.024 1.329 . . . . 0.0 112.65 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.466 HG23 HG23 ' C' ' 149' ' ' ILE . 16.8 m -96.8 -52.5 3.87 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.099 0.96 . . . . 0.0 111.41 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.5 p -53.77 -36.49 62.45 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.885 1.274 . . . . 0.0 113.076 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -52.75 -49.88 64.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.454 1.102 . . . . 0.0 112.683 171.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.57 -44.78 89.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.508 0.723 . . . . 0.0 110.811 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.4 mt -62.84 -40.05 87.29 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 122.04 -0.412 . . . . 0.0 110.281 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -64.43 -45.45 87.44 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.813 1.245 . . . . 0.0 112.937 174.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -55.48 -31.33 61.9 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.599 0.759 . . . . 0.0 112.679 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -67.52 -43.99 79.48 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 112.416 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.23 -37.98 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 120.198 -1.564 . . . . 0.0 110.638 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.86 -14.64 23.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.664 1.585 . . . . 0.0 114.008 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt -131.65 -13.99 3.26 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.4 m -147.63 -30.8 0.31 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.901 1.28 . . . . 0.0 113.175 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -74.35 -110.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.276 -1.129 . . . . 0.0 110.276 166.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 72.18 124.21 0.07 OUTLIER Glycine 0 CA--C 1.537 1.406 0 C-N-CA 126.201 1.858 . . . . 0.0 113.284 -173.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -59.44 -31.14 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -88.15 -29.52 20.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.389 1.076 . . . . 0.0 113.692 174.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -67.08 -48.15 69.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.265 1.426 . . . . 0.0 112.92 -178.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.59 -28.52 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.807 0.843 . . . . 0.0 111.851 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.35 -12.36 56.36 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.826 1.65 . . . . 0.0 114.76 173.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m120 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.765 2.026 . . . . 0.0 111.436 -177.59 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.468 0 N-CA-C 111.57 -0.612 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.1 t -61.43 137.5 58.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.873 1.269 . . . . 0.0 113.114 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -97.22 -28.4 14.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 77.0 mmm -131.41 156.98 44.64 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.833 1.653 . . . . 0.0 110.827 -175.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptp -116.95 -14.19 10.65 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -166.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -64.26 169.48 4.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.905 1.282 . . . . 0.0 111.456 164.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.28 134.55 57.1 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.643 0.777 . . . . 0.0 111.966 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 24.9 mtmm -134.61 167.93 19.92 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.551 1.14 . . . . 0.0 112.119 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 29.4 m -133.61 153.18 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 125.539 1.535 . . . . 0.0 110.215 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 23.8 ttmt -100.03 126.28 46.21 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 162.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -68.9 142.79 54.67 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 167.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.54 -2.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 120.771 -1.205 . . . . 0.0 111.876 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -154.14 157.02 32.38 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.451 1.9 . . . . 0.0 111.091 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.81 165.36 32.79 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.539 2.826 . . . . 0.0 112.774 175.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -143.96 141.29 30.12 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.87 1.268 . . . . 0.0 110.964 172.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 66.9 m -116.04 101.98 9.23 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.175 1.39 . . . . 0.0 110.188 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.81 66.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.254 1.421 . . . . 0.0 114.653 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.96 -129.45 43.89 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.512 -0.742 . . . . 0.0 112.466 -174.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 75.9 p -91.76 -3.27 56.38 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -176.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.06 160.15 21.64 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.376 1.07 . . . . 0.0 113.643 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -122.28 16.24 10.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.689 1.996 . . . . 0.0 112.449 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.0 p -133.45 16.52 4.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.348 1.859 . . . . 0.0 112.298 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 21.4 mt -118.77 155.96 30.21 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.827 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.4 tp -118.91 125.94 50.64 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.301 1.44 . . . . 0.0 110.23 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 58.8 p -110.28 149.0 30.8 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.266 1.426 . . . . 0.0 111.845 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -167.41 -179.6 4.52 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.846 1.659 . . . . 0.0 111.578 -173.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.07 -176.05 2.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.528 1.531 . . . . 0.0 111.12 169.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -68.83 146.4 52.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.045 0.938 . . . . 0.0 111.694 166.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.48 -0.88 89.43 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.016 1.293 . . . . 0.0 113.898 173.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -74.21 165.92 24.33 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.739 1.216 . . . . 0.0 112.545 175.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 83.9 t -128.51 130.81 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 124.923 1.289 . . . . 0.0 110.31 -174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.1 mm -126.54 133.56 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.012 1.325 . . . . 0.0 108.951 -177.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.4 m -98.54 120.44 38.98 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.34 1.056 . . . . 0.0 109.104 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.16 139.8 56.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.355 0.598 . . . . 0.0 110.904 -176.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 91.8 mt -113.58 -1.1 14.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.54 1.536 . . . . 0.0 112.476 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.8 pt -124.9 152.11 69.54 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 126.073 1.749 . . . . 0.0 110.252 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -73.69 -26.06 14.1 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.257 2.638 . . . . 0.0 114.401 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -155.43 158.69 39.01 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.545 1.538 . . . . 0.0 111.756 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.51 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.0 pm0 -76.82 172.34 13.27 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 121.54 9.9 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.195 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.8 t0 52.77 24.68 3.37 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 120.388 -1.445 . . . . 0.0 114.871 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.04 4.49 83.4 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.562 1.553 . . . . 0.0 115.976 -171.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -90.36 143.88 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 125.295 1.438 . . . . 0.0 111.01 167.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' B' ' 104' ' ' GLU . 18.6 mt -130.49 153.04 49.21 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.7 2.0 . . . . 0.0 110.403 176.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -124.15 134.31 53.36 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.93 0.871 . . . . 0.0 110.499 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.56 -178.04 36.91 Favored Glycine 0 CA--C 1.523 0.575 0 CA-C-N 115.162 -0.927 . . . . 0.0 113.087 -171.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.8 132.51 53.8 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.228 1.411 . . . . 0.0 109.386 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -70.7 130.28 41.33 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.188 0.995 . . . . 0.0 112.582 178.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.28 4.0 4.1 Favored 'General case' 0 CA--C 1.556 1.193 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 -176.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.32 -18.58 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -174.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 37.0 t -136.9 -16.2 1.49 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 112.68 -171.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm 62.63 17.3 9.59 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.608 1.963 . . . . 0.0 113.812 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.02 138.57 58.44 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.56 1.144 . . . . 0.0 110.855 168.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -124.64 152.23 43.88 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.045 1.738 . . . . 0.0 110.906 177.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.38 169.59 25.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.237 0.923 . . . . 0.0 112.079 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.5 128.36 35.35 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 171.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -116.83 150.93 46.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.784 1.234 . . . . 0.0 111.372 171.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 68.2 Cg_endo -73.55 119.3 5.87 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.334 2.689 . . . . 0.0 112.709 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.472 ' HB2' HD12 ' B' ' 109' ' ' LEU . 29.8 t -53.98 -42.21 68.75 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.779 1.232 . . . . 0.0 112.936 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 14.8 m -63.1 -27.41 69.37 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -82.35 7.6 13.59 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 113.373 170.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 18.4 p -135.68 167.19 21.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.512 -1.367 . . . . 0.0 112.179 -179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.12 142.42 36.04 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.509 1.124 . . . . 0.0 110.352 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.8 mt -60.02 147.66 38.27 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.312 1.045 . . . . 0.0 112.027 176.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 32.7 mt -102.78 18.4 21.56 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.217 1.407 . . . . 0.0 111.313 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.35 156.96 9.27 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 169.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.384 1.474 . . . . 0.0 113.654 178.564 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.311 -1.328 . . . . 0.0 113.146 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.78 -34.31 24.76 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.155 1.904 . . . . 0.0 113.989 -162.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -74.12 -32.53 63.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.04 -38.07 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.942 0.897 . . . . 0.0 111.035 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.33 -30.7 71.15 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.846 -1.159 . . . . 0.0 113.855 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -70.25 -23.92 62.98 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.338 0.972 . . . . 0.0 112.305 -178.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -97.45 -25.28 15.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.643 1.977 . . . . 0.0 113.599 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.45 -48.16 82.95 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.135 0.88 . . . . 0.0 111.953 172.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.9 mtt -59.33 -34.91 72.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.294 0.497 . . . . 0.0 112.045 -175.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.81 -37.08 86.39 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.425 1.09 . . . . 0.0 112.815 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -68.22 -49.98 57.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.739 0.699 . . . . 0.0 112.35 173.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 mt -61.95 -30.05 70.65 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.846 -0.534 . . . . 0.0 112.209 -174.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.47 -21.89 65.5 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.845 1.258 . . . . 0.0 113.162 178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -76.84 -20.76 55.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.404 1.482 . . . . 0.0 112.288 -178.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -116.62 -0.11 12.49 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.331 1.852 . . . . 0.0 112.283 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.12 17.2 63.26 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.036 1.303 . . . . 0.0 115.074 -172.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.466 HG23 HG23 ' A' ' 46' ' ' THR . 28.4 mm -67.9 149.99 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 118.857 1.329 . . . . 0.0 109.95 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . 0.407 HE21 ' ND2' ' C' ' 154' ' ' ASN . 15.5 mm100 -143.55 155.24 60.49 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 125.893 1.677 . . . . 0.0 111.39 177.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.21 157.3 62.0 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.028 2.485 . . . . 0.0 111.369 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.6 66.43 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.139 0.976 . . . . 0.0 113.228 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -21.0 7.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.904 1.681 . . . . 0.0 114.33 166.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . 0.407 ' ND2' HE21 ' C' ' 150' ' ' GLN . 35.8 t30 -95.89 2.91 53.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.108 1.363 . . . . 0.0 113.07 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 22.2 mtm -124.99 52.72 1.55 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.471 1.508 . . . . 0.0 111.737 -169.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -141.37 -175.87 4.51 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.372 1.869 . . . . 0.0 111.61 -173.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.37 157.87 45.77 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.468 1.107 . . . . 0.0 113.445 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -70.52 165.99 21.5 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.387 1.475 . . . . 0.0 112.622 171.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 17.7 mm -127.93 135.5 27.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.491 1.516 . . . . 0.0 109.315 174.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -67.52 172.64 10.04 Favored 'Trans proline' 0 CA--C 1.551 1.333 1 C-N-CA 125.505 4.137 . . . . 0.0 113.996 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -66.79 -75.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.59 2.86 . . . . 0.0 114.185 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.47 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.62 162.08 0.0 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 129.418 3.087 . . . . 0.0 112.307 -172.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.47 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 75.7 Cg_endo -71.09 172.12 14.54 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.0 3.133 . . . . 0.0 113.436 172.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -92.32 11.16 26.85 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 125.112 1.365 . . . . 0.0 114.032 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.9 p90 -140.92 158.63 64.61 Favored Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 125.848 1.659 . . . . 0.0 111.18 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -71.35 157.73 56.07 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.582 2.188 . . . . 0.0 113.493 178.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -62.21 130.55 93.07 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 55.2 Cg_endo -67.69 160.2 49.25 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.761 2.974 . . . . 0.0 112.781 178.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 16.4 p -116.68 151.91 47.75 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.27 1.428 . . . . 0.0 112.879 -172.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.98 167.6 17.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.446 3.431 . . . . 0.0 114.381 -174.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.87 76.98 1.95 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 125.116 3.877 . . . . 0.0 110.958 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.79 154.38 26.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 125.491 1.516 . . . . 0.0 109.753 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -123.98 136.3 54.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.798 1.239 . . . . 0.0 109.346 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -132.87 138.26 46.96 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.776 1.23 . . . . 0.0 109.951 -174.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.93 149.74 49.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.344 0.658 . . . . 0.0 111.58 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -137.3 149.02 46.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.677 1.191 . . . . 0.0 112.062 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 26.1 t -156.38 151.53 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 110.952 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -65.67 153.1 91.52 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.388 1.075 . . . . 0.0 112.112 171.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.254 1.323 0 C-N-CA 124.16 3.24 . . . . 0.0 113.23 178.706 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.6 m -145.71 161.99 38.62 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.928 1.691 . . . . 0.0 111.541 -175.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -148.7 -176.38 5.3 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.434 1.494 . . . . 0.0 112.311 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -119.93 171.51 8.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.566 1.546 . . . . 0.0 113.16 -177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -116.9 -67.94 0.96 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.845 1.658 . . . . 0.0 112.064 -175.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.92 -15.11 63.01 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.9 pt -141.28 -173.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.533 2.333 . . . . 0.0 109.477 -177.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 131.1 -24.16 4.27 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.748 1.166 . . . . 0.0 111.788 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -66.57 -34.97 79.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.572 1.949 . . . . 0.0 114.593 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.6 161.67 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 124.314 1.046 . . . . 0.0 111.623 -175.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -130.12 31.29 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.989 1.28 . . . . 0.0 114.339 -175.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -83.57 151.36 25.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.286 1.043 . . . . 0.0 112.698 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -139.62 143.8 36.77 Favored Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 172.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.76 7.36 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.839 1 C-N-CA 125.786 4.324 . . . . 0.0 115.64 -178.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -123.48 -19.09 5.98 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.174 1.389 . . . . 0.0 114.295 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.2 p -135.43 -29.77 1.06 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.369 1.068 . . . . 0.0 113.126 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.21 -162.56 15.97 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 124.848 1.213 . . . . 0.0 114.303 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -61.3 141.67 57.41 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.992 0.917 . . . . 0.0 111.434 175.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -87.78 79.44 8.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.447 ' H ' HD22 ' A' ' 20' ' ' LEU . 1.2 mm? -47.32 -42.49 21.28 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.671 1.188 . . . . 0.0 113.561 -176.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -59.05 -23.2 61.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.061 1.344 . . . . 0.0 114.279 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -132.86 19.82 4.16 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.547 1.139 . . . . 0.0 113.342 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 27' ' ' LEU . 7.1 mt -60.96 150.85 32.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.284 1.04 . . . . 0.0 112.81 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' HB2' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.49 157.44 65.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.502 1.521 . . . . 0.0 113.027 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.62 -11.41 30.45 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 124.118 3.212 . . . . 0.0 113.838 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -122.0 -9.12 8.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.033 1.333 . . . . 0.0 112.905 -178.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.441 HD22 HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -75.24 -66.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.424 -0.797 . . . . 0.0 111.339 -179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -29.83 62.52 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.12 0.968 . . . . 0.0 112.876 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -64.67 -42.03 95.66 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.486 1.114 . . . . 0.0 110.828 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.435 HD21 HD22 ' C' ' 140' ' ' LEU . 7.9 tp -70.23 -42.91 71.61 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.893 0.877 . . . . 0.0 111.606 173.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.513 ' CD2' HD21 ' A' ' 41' ' ' LEU . 20.1 m-30 -55.72 -46.95 77.64 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.017 0.371 . . . . 0.0 110.485 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -68.6 -22.4 64.45 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.48 ' CE ' HD22 ' C' ' 133' ' ' LEU . 10.7 tpp -75.58 -57.37 3.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.179 0.992 . . . . 0.0 111.457 177.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -29.8 67.11 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.39 7.23 10.1 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.915 1.721 . . . . 0.0 113.699 175.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.49 146.52 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 118.733 1.267 . . . . 0.0 110.474 173.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -126.51 166.83 16.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.499 0.72 . . . . 0.0 112.865 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -51.9 -29.82 21.53 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.144 1.778 . . . . 0.0 114.508 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.25 95.35 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.288 -0.883 . . . . 0.0 113.283 172.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -68.65 -38.43 80.46 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.262 0.625 . . . . 0.0 110.746 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.513 HD21 ' CD2' ' A' ' 31' ' ' PHE . 1.1 mp -63.92 -26.02 68.41 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 126.097 1.759 . . . . 0.0 113.24 176.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -97.19 1.16 49.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.116 1.367 . . . . 0.0 112.908 175.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -89.06 114.92 26.2 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.589 1.155 . . . . 0.0 110.066 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -15.15 29.06 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -99.89 -21.1 15.83 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.0 1.32 . . . . 0.0 112.534 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.532 HG23 HG23 ' C' ' 149' ' ' ILE . 17.7 m -105.72 -52.06 2.88 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.787 0.835 . . . . 0.0 111.553 178.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.4 p -55.24 -34.87 64.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.763 1.225 . . . . 0.0 113.294 176.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -53.1 -50.06 65.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.503 1.121 . . . . 0.0 112.803 171.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -67.88 -43.66 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.753 0.821 . . . . 0.0 110.618 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.2 mt -62.09 -39.08 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 122.701 0.4 . . . . 0.0 110.518 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -66.87 -44.81 79.97 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.806 -1.184 . . . . 0.0 112.827 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.73 -32.39 59.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.987 0.515 . . . . 0.0 112.283 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -66.79 -45.55 78.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.824 0.849 . . . . 0.0 112.968 173.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.3 mt -63.65 -40.3 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 O-C-N 120.465 -1.397 . . . . 0.0 110.978 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -22.22 66.38 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 178.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.75 -14.64 13.55 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.4 m -147.48 -29.23 0.35 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -170.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -103.08 -17.05 19.48 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 116.321 1.288 . . . . 0.0 116.321 -165.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -21.16 122.38 0.01 OUTLIER Glycine 0 C--N 1.342 0.903 0 C-N-CA 129.219 3.295 . . . . 0.0 115.254 169.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.1 p -48.06 -29.96 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 126.394 1.878 . . . . 0.0 115.676 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.57 -28.87 24.58 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.94 -1.1 . . . . 0.0 113.904 174.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.26 -40.24 81.99 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 112.843 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 m -72.14 -22.42 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 125.033 1.333 . . . . 0.0 113.39 175.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -40.92 84.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.734 1.213 . . . . 0.0 113.029 175.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.071 1.748 . . . . 0.0 112.162 -179.317 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 CA-C-O 119.669 -0.517 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 8.0 m 51.72 37.28 19.78 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.016 1.726 . . . . 0.0 115.648 171.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -137.44 171.61 14.22 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.592 1.157 . . . . 0.0 113.775 -174.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 22.2 mmt -87.85 16.74 5.47 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.228 1.811 . . . . 0.0 114.314 -170.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt 47.17 32.97 2.24 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 130.198 3.399 . . . . 0.0 115.36 -169.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -137.86 167.13 22.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.522 1.929 . . . . 0.0 111.479 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -63.07 161.79 12.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.905 1.682 . . . . 0.0 112.891 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -128.63 162.97 26.08 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.342 1.057 . . . . 0.0 112.361 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 m -138.36 151.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.437 1.495 . . . . 0.0 110.548 173.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -97.72 126.64 43.16 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.415 1.086 . . . . 0.0 108.234 166.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 14.8 p -69.86 130.03 41.13 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 168.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -104.77 -0.48 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 O-C-N 120.217 -1.552 . . . . 0.0 111.926 176.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -152.91 155.13 31.98 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.123 1.769 . . . . 0.0 111.161 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.56 161.53 43.82 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.682 2.922 . . . . 0.0 113.001 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 -143.85 150.36 38.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.184 1.394 . . . . 0.0 110.908 171.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 89.8 m -133.62 109.81 9.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.593 1.557 . . . . 0.0 109.889 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.03 -26.48 67.65 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.24 41.46 94.75 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 121.171 -0.955 . . . . 0.0 113.61 -176.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 5.5 t 71.84 16.03 5.66 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.639 1.976 . . . . 0.0 115.282 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.98 164.41 20.05 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 112.785 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -113.52 4.65 16.29 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.977 1.711 . . . . 0.0 113.996 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -128.27 3.54 5.75 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.284 1.833 . . . . 0.0 113.524 176.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 45.7 mt -104.55 163.32 12.55 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.37 0.986 . . . . 0.0 112.919 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.8 tp -123.21 122.39 38.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.856 1.662 . . . . 0.0 109.982 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 45.6 m -102.89 147.83 26.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.118 0.967 . . . . 0.0 111.555 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -162.87 177.78 8.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.276 1.43 . . . . 0.0 111.786 -178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.69 -177.2 3.28 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.412 1.485 . . . . 0.0 111.473 171.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -69.63 145.31 52.56 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.164 -0.96 . . . . 0.0 111.301 166.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 84.48 1.19 89.35 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 125.113 1.34 . . . . 0.0 113.864 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.38 167.41 20.24 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.899 1.28 . . . . 0.0 112.351 175.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 86.5 t -131.94 132.24 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.724 1.209 . . . . 0.0 110.607 -171.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 8.8 mm -127.0 138.07 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.18 1.392 . . . . 0.0 109.183 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.2 m -103.33 119.18 38.38 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.543 1.137 . . . . 0.0 108.907 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.56 149.83 45.4 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.862 0.756 . . . . 0.0 111.34 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 97.3 mt -126.57 4.0 6.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.121 1.368 . . . . 0.0 112.333 177.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 46.1 pt -129.11 154.02 80.42 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.823 1.649 . . . . 0.0 111.124 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.89 -26.3 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.823 3.015 . . . . 0.0 114.841 -177.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -154.85 161.27 41.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.177 1.391 . . . . 0.0 111.895 -176.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.89 166.66 22.55 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 122.05 13.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.128 174.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.6 t0 52.07 24.02 2.51 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.865 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.37 -6.29 77.17 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 125.63 1.585 . . . . 0.0 115.898 -173.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.486 ' C ' HD22 ' B' ' 109' ' ' LEU . 98.3 m95 -87.03 134.16 33.52 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.496 1.918 . . . . 0.0 111.875 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' B' ' 124' ' ' SER . 3.5 mm? -121.1 154.15 36.53 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.741 2.016 . . . . 0.0 109.463 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -124.95 134.53 52.6 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.59 0.71 . . . . 0.0 110.603 -175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -162.99 -177.17 35.77 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.276 -0.874 . . . . 0.0 114.04 -173.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -125.88 126.63 44.76 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 109.694 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.408 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.6 t-80 -68.69 128.47 36.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.474 1.11 . . . . 0.0 112.705 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -75.58 12.52 1.0 Allowed 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' B' ' 113' ' ' HIS . 3.0 m -130.35 -17.83 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 125.082 1.353 . . . . 0.0 114.288 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 47.8 t -136.7 -19.72 1.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.801 1.64 . . . . 0.0 112.707 -169.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp 64.9 12.69 8.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.758 2.023 . . . . 0.0 113.977 -177.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.95 140.65 58.89 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.819 1.248 . . . . 0.0 110.729 168.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 34.1 mtt85 -123.59 153.28 40.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.73 1.612 . . . . 0.0 110.975 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.87 167.39 25.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 123.715 0.674 . . . . 0.0 111.987 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -71.61 132.31 44.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 171.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -129.19 153.32 80.4 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.902 1.281 . . . . 0.0 112.154 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.84 115.51 4.33 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.681 2.921 . . . . 0.0 112.917 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.504 ' HB2' HD23 ' B' ' 109' ' ' LEU . 6.4 t -60.36 -27.57 67.5 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 171.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.43 -30.65 71.38 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.18 -0.95 . . . . 0.0 113.259 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -83.96 6.2 22.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.855 1.262 . . . . 0.0 114.007 172.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 10.3 p -131.83 170.9 14.2 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.648 -1.282 . . . . 0.0 112.23 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -151.49 161.74 42.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.045 0.938 . . . . 0.0 111.478 167.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.2 154.55 5.68 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.335 1.054 . . . . 0.0 113.015 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 12.4 mt -103.34 15.57 28.77 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.356 1.462 . . . . 0.0 112.102 174.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -67.99 -16.03 63.87 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 126.221 1.808 . . . . 0.0 115.135 176.003 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.48 HD22 ' CE ' ' A' ' 33' ' ' MET . 1.6 mt . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 117.226 -1.368 . . . . 0.0 113.054 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.12 -35.25 14.92 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.984 1.789 . . . . 0.0 113.292 -167.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -41.4 79.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.689 0.796 . . . . 0.0 111.952 174.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.15 -41.12 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.437 1.095 . . . . 0.0 111.728 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.88 -35.61 77.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.71 -26.53 68.41 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.553 0.615 . . . . 0.0 112.122 177.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -88.14 -33.95 18.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.118 1.767 . . . . 0.0 111.616 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.435 HD22 HD21 ' A' ' 30' ' ' LEU . 58.8 tp -59.25 -48.79 80.31 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.389 0.675 . . . . 0.0 111.452 176.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 46.5 mtt -58.27 -36.14 72.82 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.249 0.477 . . . . 0.0 112.17 -176.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.45 -40.15 95.18 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.614 1.166 . . . . 0.0 112.0 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -66.82 -49.34 66.11 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.548 0.739 . . . . 0.0 112.539 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.26 -29.41 70.74 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.761 -0.587 . . . . 0.0 112.256 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.82 -21.32 65.22 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.688 1.195 . . . . 0.0 113.11 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.78 -19.83 51.29 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.499 1.52 . . . . 0.0 112.389 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -117.33 -0.57 11.97 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.312 1.845 . . . . 0.0 112.293 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 65.09 18.17 64.44 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 125.06 1.314 . . . . 0.0 115.043 -172.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.532 HG23 HG23 ' A' ' 46' ' ' THR . 34.0 mm -65.99 149.53 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 119.085 1.442 . . . . 0.0 109.575 169.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -141.97 153.16 63.65 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 110.637 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.07 162.36 35.89 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.029 2.486 . . . . 0.0 111.535 173.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.5 64.66 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.051 -1.031 . . . . 0.0 112.86 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -69.82 -4.0 18.19 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.548 1.539 . . . . 0.0 114.036 165.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -138.14 30.45 2.45 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.467 1.507 . . . . 0.0 113.305 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 8.0 mtp -63.97 140.4 58.87 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.114 -0.991 . . . . 0.0 112.219 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.33 170.19 22.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.118 1.367 . . . . 0.0 111.631 174.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -157.89 -176.52 5.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.3 1.84 . . . . 0.0 111.331 -177.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.96 -50.37 2.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.893 1.277 . . . . 0.0 114.141 -176.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 11.2 mm 65.34 131.35 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.273 0 C-N-CA 127.723 2.409 . . . . 0.0 113.491 -174.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.0 171.39 10.11 Favored 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.918 3.745 . . . . 0.0 113.368 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -66.06 -74.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.218 2.612 . . . . 0.0 114.202 -178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.482 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 149.03 162.58 0.0 OUTLIER Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 129.587 3.155 . . . . 0.0 112.565 -172.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.482 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 86.6 Cg_endo -72.06 172.01 15.57 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.164 3.242 . . . . 0.0 113.746 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -84.89 0.34 51.41 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.296 1.439 . . . . 0.0 114.432 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -136.12 159.51 70.68 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 125.554 1.542 . . . . 0.0 111.675 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.26 157.87 55.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.816 2.344 . . . . 0.0 114.071 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -65.46 134.91 95.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.19 168.83 18.14 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.95 3.1 . . . . 0.0 113.689 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 22.6 p -128.72 149.97 73.56 Favored Pre-proline 0 N--CA 1.477 0.907 0 C-N-CA 125.786 1.634 . . . . 0.0 112.759 -171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -68.47 169.84 16.27 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.736 3.624 . . . . 0.0 112.9 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.17 77.73 1.56 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.574 3.516 . . . . 0.0 111.73 176.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.4 p -144.94 119.85 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.503 1.121 . . . . 0.0 111.243 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -147.17 -177.72 5.83 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.696 1.999 . . . . 0.0 110.448 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -73.63 80.6 1.51 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.602 1.561 . . . . 0.0 112.206 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 174.04 11.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.481 1.113 . . . . 0.0 113.48 175.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -105.32 152.75 22.53 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.547 1.139 . . . . 0.0 112.714 173.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 62.2 m -148.45 176.24 10.46 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.164 1.785 . . . . 0.0 111.355 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.55 64.16 9.02 Favored Pre-proline 0 N--CA 1.485 1.31 0 C-N-CA 125.948 1.699 . . . . 0.0 113.012 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--O 1.251 1.154 0 C-N-CA 124.137 3.225 . . . . 0.0 113.192 178.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.168 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.7 p -142.45 31.6 1.5 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.104 1.362 . . . . 0.0 113.542 -168.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -134.52 138.58 44.77 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.163 1.385 . . . . 0.0 111.246 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -145.63 -175.84 4.89 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.052 1.741 . . . . 0.0 111.657 -173.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -85.72 -76.94 0.31 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.696 0.798 . . . . 0.0 112.522 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.54 -11.91 61.11 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.1 pt -140.53 -174.43 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.54 2.336 . . . . 0.0 109.42 -177.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 141.45 -32.15 2.09 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.606 1.098 . . . . 0.0 111.047 166.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.427 ' CE1' HG23 ' A' ' 60' ' ' VAL . 2.0 p80 -59.26 -39.96 84.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.805 2.042 . . . . 0.0 114.605 175.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -73.04 134.65 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.547 1.139 . . . . 0.0 110.42 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -110.53 27.03 11.87 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.354 1.454 . . . . 0.0 114.662 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -70.47 150.52 46.1 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.531 1.132 . . . . 0.0 112.334 -177.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -136.51 144.83 48.96 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 170.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.96 4.37 2.76 Favored 'Trans proline' 0 C--N 1.355 0.905 1 C-N-CA 125.56 4.173 . . . . 0.0 115.169 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -113.4 -28.69 7.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.349 1.46 . . . . 0.0 113.525 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 67.9 p -134.76 -32.77 0.97 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.403 1.081 . . . . 0.0 113.686 -169.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.9 -160.75 13.02 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 124.592 1.091 . . . . 0.0 114.903 175.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -65.09 144.93 56.92 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.67 0.735 . . . . 0.0 111.6 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -82.4 71.86 9.47 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 122.106 0.955 . . . . 0.0 112.271 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.5 mt -47.94 -36.18 11.99 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.639 1.976 . . . . 0.0 113.576 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -59.74 -28.5 67.42 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.077 1.351 . . . . 0.0 114.046 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -138.61 25.08 2.63 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.305 1.042 . . . . 0.0 113.309 -177.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 mt -57.96 149.26 23.44 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.014 0.926 . . . . 0.0 112.649 -177.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.62 158.11 61.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.575 1.15 . . . . 0.0 112.712 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.28 -8.56 20.84 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.942 3.761 . . . . 0.0 114.184 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -116.91 -20.12 9.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.27 1.428 . . . . 0.0 113.289 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -72.06 -68.1 0.49 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.937 1.295 . . . . 0.0 111.287 -171.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.21 -31.13 61.21 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.74 0.816 . . . . 0.0 112.451 172.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.77 -45.47 82.37 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.609 1.164 . . . . 0.0 109.977 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.593 HD21 HD22 ' C' ' 140' ' ' LEU . 3.1 tp -66.63 -42.84 86.1 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.76 1.224 . . . . 0.0 112.05 171.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -56.01 -46.0 78.92 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.743 -0.598 . . . . 0.0 110.679 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -69.14 -24.27 64.07 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.413 1.085 . . . . 0.0 113.615 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.2 tpp -72.69 -59.14 2.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.24 1.016 . . . . 0.0 111.123 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.3 t -68.9 -36.33 77.91 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.444 0.298 . . . . 0.0 111.418 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 6.66 6.39 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.472 1.034 . . . . 0.0 114.806 176.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.405 HD11 HD21 ' C' ' 140' ' ' LEU . 3.0 mp -61.48 143.86 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 118.517 1.159 . . . . 0.0 110.676 173.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.9 t -121.76 162.98 19.87 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.041 0.936 . . . . 0.0 111.916 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -51.8 -32.65 32.26 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.288 1.435 . . . . 0.0 113.859 -177.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.34 -43.09 78.72 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -72.07 -39.72 68.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.52 0.728 . . . . 0.0 111.023 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -24.98 67.25 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.176 1.39 . . . . 0.0 113.791 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -93.01 -4.19 53.05 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.343 1.457 . . . . 0.0 113.205 172.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.4 112.96 21.96 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.95 0.9 . . . . 0.0 109.647 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.4 ' HD3' ' H ' ' A' ' 44' ' ' ARG . 0.1 OUTLIER -60.49 -13.2 12.44 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 179.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -102.54 -19.77 14.74 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.452 1.501 . . . . 0.0 112.77 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.629 HG23 HG23 ' C' ' 149' ' ' ILE . 30.0 m -106.85 -51.82 2.87 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.127 0.971 . . . . 0.0 111.642 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 81.1 p -53.94 -35.27 61.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.81 1.244 . . . . 0.0 112.918 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -52.6 -49.91 64.1 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.789 1.235 . . . . 0.0 113.002 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.49 -43.11 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.845 0.858 . . . . 0.0 110.773 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 mt -62.25 -39.58 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 O-C-N 122.031 -0.418 . . . . 0.0 110.233 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.36 -44.58 78.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.4 1.08 . . . . 0.0 112.946 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.52 -33.58 55.05 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.39 0.676 . . . . 0.0 112.659 176.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -66.29 -49.57 66.61 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.427 0.691 . . . . 0.0 112.115 173.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 mt -64.14 -36.74 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.309 -1.494 . . . . 0.0 110.989 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -64.45 -12.93 48.6 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.389 1.076 . . . . 0.0 113.575 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.98 -11.86 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.0 m -150.51 -24.83 0.24 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.101 1.36 . . . . 0.0 113.057 -169.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -80.78 -110.9 0.3 Allowed Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.275 -1.291 . . . . 0.0 110.847 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.43 125.93 0.01 OUTLIER Glycine 0 CA--C 1.536 1.397 0 C-N-CA 127.744 2.592 . . . . 0.0 115.517 -170.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.427 HG23 ' CE1' ' A' ' 9' ' ' HIS . 3.7 t -55.43 -38.74 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 O-C-N 120.92 -1.341 . . . . 0.0 113.641 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.95 -28.05 49.41 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.243 -0.911 . . . . 0.0 113.177 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -71.84 -43.08 66.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.03 1.332 . . . . 0.0 112.534 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.9 t -66.27 -23.24 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.523 1.529 . . . . 0.0 112.388 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -22.07 61.42 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 171.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.799 2.44 . . . . 0.0 114.084 -178.561 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 111.599 -0.6 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -61.75 125.31 23.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.366 1.066 . . . . 0.0 112.492 -179.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -158.5 155.94 29.35 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.383 1.473 . . . . 0.0 110.938 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 23.3 ptp -65.48 173.46 2.67 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.836 0.854 . . . . 0.0 112.979 167.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -59.03 156.3 12.04 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 121.398 -0.814 . . . . 0.0 112.69 174.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -88.66 16.32 6.86 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.075 1.75 . . . . 0.0 114.856 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -122.22 130.43 53.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.242 1.417 . . . . 0.0 110.526 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . 0.453 ' HG2' HG23 ' B' ' 98' ' ' THR . 24.6 mtmt -143.48 167.67 21.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.645 1.178 . . . . 0.0 111.402 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.02 158.66 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.106 1.362 . . . . 0.0 111.542 175.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -102.68 128.0 49.56 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.455 1.102 . . . . 0.0 108.663 166.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 12.2 p -72.76 145.21 47.24 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.79 -3.02 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.517 1.127 . . . . 0.0 111.79 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -152.3 157.33 33.89 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.949 1.7 . . . . 0.0 110.943 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.26 161.32 46.16 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.532 2.821 . . . . 0.0 112.85 176.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -141.47 147.78 38.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 110.911 171.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 35.8 m -133.19 103.72 6.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.38 1.472 . . . . 0.0 109.991 -171.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.11 -27.47 68.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.198 1.399 . . . . 0.0 114.168 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.95 -72.85 1.55 Allowed Glycine 0 CA--C 1.533 1.215 0 C-N-CA 126.073 1.797 . . . . 0.0 114.129 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 22.1 m -144.93 0.64 0.96 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -80.34 165.96 21.78 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.487 1.115 . . . . 0.0 112.987 -178.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -121.32 9.17 10.33 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.374 1.869 . . . . 0.0 112.22 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.53 15.18 7.09 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.204 1.802 . . . . 0.0 111.672 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -115.41 157.13 24.36 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.989 1.316 . . . . 0.0 112.235 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -120.35 121.12 37.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.015 1.326 . . . . 0.0 110.715 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 55.7 p -101.95 152.3 21.1 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.774 1.23 . . . . 0.0 112.41 178.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -169.85 179.93 3.48 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.064 1.746 . . . . 0.0 111.832 -175.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -108.89 -177.47 3.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.939 1.696 . . . . 0.0 111.256 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? -66.86 145.52 55.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.151 0.98 . . . . 0.0 111.319 165.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.5 -0.86 88.81 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.792 1.186 . . . . 0.0 113.704 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -75.13 166.55 23.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.834 1.253 . . . . 0.0 112.542 174.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 50.0 t -129.97 132.1 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.581 1.152 . . . . 0.0 110.719 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 9.9 mm -128.97 128.8 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 125.075 1.35 . . . . 0.0 108.804 -176.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . 0.453 HG23 ' HG2' ' B' ' 73' ' ' LYS . 20.5 m -87.06 125.63 34.24 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 171.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.48 143.66 53.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.854 0.752 . . . . 0.0 110.24 174.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.42 1.56 13.71 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.183 1.393 . . . . 0.0 112.166 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 48.8 pt -129.95 153.75 81.05 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 110.5 -174.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.8 -24.71 11.35 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.491 2.794 . . . . 0.0 114.809 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -153.44 163.52 39.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.583 1.553 . . . . 0.0 111.738 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.552 ' HB3' HD21 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -83.82 172.0 12.58 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 179.006 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 119.77 8.83 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.466 -178.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 12.4 t0 53.07 24.58 3.59 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 120.351 -1.468 . . . . 0.0 114.725 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.01 3.91 82.12 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.617 1.579 . . . . 0.0 116.095 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -89.8 144.35 26.03 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.078 1.351 . . . . 0.0 111.042 168.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' B' ' 104' ' ' GLU . 22.7 mt -130.58 142.97 50.46 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.528 1.931 . . . . 0.0 110.04 176.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -110.65 137.74 47.93 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.839 0.745 . . . . 0.0 110.295 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -165.46 -173.31 33.87 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-N 115.656 -0.702 . . . . 0.0 114.361 -172.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -134.08 127.4 32.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.625 1.97 . . . . 0.0 109.621 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -68.85 131.47 45.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.178 0.991 . . . . 0.0 112.565 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -80.61 14.9 1.88 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -177.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 3.4 m -124.64 -21.63 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 124.793 1.237 . . . . 0.0 113.809 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 16.8 t -140.4 -6.96 1.17 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.942 1.297 . . . . 0.0 113.55 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 58.9 21.29 8.98 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.23 1.812 . . . . 0.0 113.793 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.52 141.41 51.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.277 1.431 . . . . 0.0 110.472 171.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 40.5 mtt85 -128.62 151.95 48.91 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.116 1.366 . . . . 0.0 111.422 -174.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 161.82 170.38 26.46 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.105 0.86 . . . . 0.0 112.197 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -72.52 129.47 38.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -119.29 151.69 51.45 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.276 1.43 . . . . 0.0 111.227 172.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.16 120.35 6.53 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.246 2.631 . . . . 0.0 112.98 177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.462 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 29.4 t -54.54 -38.97 67.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.438 1.095 . . . . 0.0 112.806 173.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.71 -30.73 70.94 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -178.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -83.04 8.58 12.44 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.89 1.276 . . . . 0.0 113.462 172.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 20.2 p -135.29 -177.43 4.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.09 1.756 . . . . 0.0 111.132 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.449 ' HG3' ' H ' ' B' ' 129' ' ' LEU . 15.3 pttp -147.82 -96.38 0.08 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.888 0.875 . . . . 0.0 111.871 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . 0.449 ' H ' ' HG3' ' B' ' 128' ' ' LYS . 50.0 mt -141.86 174.2 10.81 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.045 2.938 . . . . 0.0 109.199 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 1.1 mt -115.08 7.6 15.48 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.432 1.093 . . . . 0.0 112.558 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.12 157.2 29.26 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.978 0.911 . . . . 0.0 112.641 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 127.23 2.212 . . . . 0.0 114.553 -174.989 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' C' ' 133' ' ' LEU . 3.6 mt . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.363 -1.303 . . . . 0.0 113.22 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.84 -37.71 8.62 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.047 1.831 . . . . 0.0 113.899 -163.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -72.93 -32.95 65.63 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.767 -0.583 . . . . 0.0 112.382 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 96.4 t -64.37 -40.42 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.263 1.025 . . . . 0.0 110.821 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.3 -27.6 68.04 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.573 -1.33 . . . . 0.0 113.34 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -27.81 69.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.573 0.749 . . . . 0.0 112.139 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -104.63 -22.04 13.31 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.117 2.167 . . . . 0.0 113.115 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 30' ' ' LEU . 50.5 tp -63.37 -51.1 67.3 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.654 0.661 . . . . 0.0 111.459 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 65.0 mtm -61.62 -29.09 69.83 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -67.46 -42.11 83.55 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.892 0.877 . . . . 0.0 112.497 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -64.3 -48.35 75.99 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.277 0.944 . . . . 0.0 112.391 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 64.8 mt -67.85 -23.5 65.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.338 -0.851 . . . . 0.0 112.944 -174.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -72.9 -22.77 60.69 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.672 1.189 . . . . 0.0 113.008 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -77.82 -20.93 52.33 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.382 1.473 . . . . 0.0 112.469 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -117.16 3.62 12.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.948 1.699 . . . . 0.0 111.989 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 62.44 26.41 68.07 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.755 1.645 . . . . 0.0 114.888 -178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.629 HG23 HG23 ' A' ' 46' ' ' THR . 6.9 mm -64.16 -64.38 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.507 1.123 . . . . 0.0 112.585 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 52.96 157.61 0.05 OUTLIER Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 129.316 3.046 . . . . 0.0 115.114 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.26 162.94 38.24 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 122.694 2.263 . . . . 0.0 112.536 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.27 -19.46 65.51 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.261 -0.899 . . . . 0.0 113.052 177.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -65.22 -0.33 1.7 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.391 1.876 . . . . 0.0 114.864 165.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -127.23 68.47 1.28 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.766 1.627 . . . . 0.0 110.344 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 37.2 mtt -136.44 174.67 10.37 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.37 1.868 . . . . 0.0 111.672 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . 63.75 178.89 0.16 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.772 2.029 . . . . 0.0 114.295 -171.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.78 166.54 30.16 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -169.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -81.54 175.95 10.08 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 112.546 175.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 25.9 mm -116.3 135.48 22.85 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.875 1.27 . . . . 0.0 109.862 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.29 172.64 9.8 Favored 'Trans proline' 0 CA--C 1.549 1.257 1 C-N-CA 125.327 4.018 . . . . 0.0 113.726 177.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.75 -75.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 123.443 2.762 . . . . 0.0 114.041 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.492 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 151.05 162.11 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 129.676 3.19 . . . . 0.0 112.372 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.492 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 71.6 Cg_endo -71.18 169.54 20.4 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.027 3.151 . . . . 0.0 113.624 173.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -81.12 -6.37 58.75 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.038 1.335 . . . . 0.0 114.557 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.4 p90 -128.94 158.83 71.4 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.682 1.593 . . . . 0.0 111.709 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.84 157.24 58.83 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.543 2.162 . . . . 0.0 113.26 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.52 132.05 88.34 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 123.024 0.529 . . . . 0.0 112.406 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.94 164.41 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.312 2.675 . . . . 0.0 112.708 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 23.8 p -124.29 147.62 55.48 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.066 1.346 . . . . 0.0 112.5 -172.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -68.94 161.46 45.62 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.603 3.535 . . . . 0.0 113.721 -172.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.67 78.66 1.65 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 124.639 3.56 . . . . 0.0 111.742 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 28.3 t -129.99 77.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.194 1.397 . . . . 0.0 109.234 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -154.78 172.9 17.22 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.408 1.483 . . . . 0.0 110.181 175.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -56.55 157.5 5.17 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.209 1.004 . . . . 0.0 112.881 173.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -55.68 130.12 41.91 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.395 1.478 . . . . 0.0 113.277 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -74.44 167.37 21.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.85 1.26 . . . . 0.0 112.953 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 66.2 m -137.01 163.47 30.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.845 1.658 . . . . 0.0 111.61 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -141.32 59.42 10.34 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.857 1.263 . . . . 0.0 112.421 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--O 1.251 1.164 0 C-N-CA 123.997 3.131 . . . . 0.0 113.343 -178.289 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.857 -0.497 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 p -90.09 179.53 5.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.89 8.38 44.81 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.991 1.316 . . . . 0.0 113.689 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.68 174.65 10.72 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.2 -62.26 1.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.848 1.659 . . . . 0.0 112.895 -175.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.51 -13.16 38.19 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 175.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.546 HG13 ' H ' ' A' ' 8' ' ' GLY . 20.2 pt -133.52 -66.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.749 1.22 . . . . 0.0 111.294 -178.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.546 ' H ' HG13 ' A' ' 7' ' ' ILE . . . 73.88 6.67 73.57 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.586 1.089 . . . . 0.0 115.344 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -123.23 8.38 9.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.272 1.429 . . . . 0.0 113.388 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 t -136.84 124.59 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.505 1.122 . . . . 0.0 109.738 -171.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -106.95 35.35 5.09 Favored Glycine 0 N--CA 1.473 1.128 0 C-N-CA 124.874 1.226 . . . . 0.0 113.634 -170.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -80.67 149.9 29.61 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.779 0.831 . . . . 0.0 112.428 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -137.32 143.94 43.51 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 171.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.72 0.43 5.62 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 125.075 3.85 . . . . 0.0 115.491 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -108.04 -30.44 8.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.611 1.164 . . . . 0.0 113.131 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 74.6 p -130.45 -27.03 2.22 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.587 1.155 . . . . 0.0 113.546 -169.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.85 -162.16 17.47 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.498 1.047 . . . . 0.0 114.213 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -60.91 145.67 49.45 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 111.593 176.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -92.19 78.01 5.21 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.535 0.734 . . . . 0.0 111.746 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' H ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -47.47 -43.29 24.21 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.753 1.221 . . . . 0.0 113.771 -176.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 m-20 -60.07 -18.85 49.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.352 1.461 . . . . 0.0 114.387 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -137.17 19.36 2.97 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.676 1.59 . . . . 0.0 112.879 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 mt -64.01 151.08 43.86 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.408 1.099 . . . . 0.0 112.589 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.86 160.89 51.19 Favored Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 126.152 1.781 . . . . 0.0 113.33 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.71 -10.63 28.83 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.738 2.959 . . . . 0.0 114.043 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -110.41 -25.89 9.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.933 1.293 . . . . 0.0 112.434 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.45 -66.21 0.63 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.012 0.925 . . . . 0.0 111.06 -166.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.99 -31.65 61.09 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.66 0.784 . . . . 0.0 112.968 173.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -68.79 -48.01 64.73 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.25 1.02 . . . . 0.0 111.093 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.619 HD11 HD22 ' C' ' 140' ' ' LEU . 1.0 OUTLIER -61.07 -43.3 99.1 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.455 1.502 . . . . 0.0 111.413 169.724 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.514 ' CD2' HD21 ' A' ' 41' ' ' LEU . 22.3 m-85 -59.37 -45.24 91.97 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.636 0.653 . . . . 0.0 110.305 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -68.48 -24.98 64.75 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.856 0.862 . . . . 0.0 113.315 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 30.0 tpp -67.6 -57.79 5.82 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.101 0.96 . . . . 0.0 111.186 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.7 t -68.57 -32.91 73.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.889 0.475 . . . . 0.0 110.99 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.56 11.79 6.44 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.277 1.418 . . . . 0.0 114.544 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD11 HD21 ' C' ' 140' ' ' LEU . 2.7 mp -66.07 141.45 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.2 t -112.58 157.68 20.88 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 111.789 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.88 -27.48 12.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.778 1.631 . . . . 0.0 114.178 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.16 91.54 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 170.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.2 -36.21 69.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.06 0.944 . . . . 0.0 111.171 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.514 HD21 ' CD2' ' A' ' 31' ' ' PHE . 5.7 mp -61.67 -27.14 68.47 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.254 1.822 . . . . 0.0 113.254 172.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -97.16 0.58 48.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.987 1.315 . . . . 0.0 113.07 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -88.22 112.32 22.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.878 1.271 . . . . 0.0 109.6 178.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HD3' ' A' ' 44' ' ' ARG . 0.6 OUTLIER -59.89 -13.93 13.12 Favored 'General case' 0 N--CA 1.481 1.113 0 O-C-N 120.959 -1.088 . . . . 0.0 113.916 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -101.86 -22.61 14.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.385 1.474 . . . . 0.0 112.721 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.474 HG23 HG23 ' C' ' 149' ' ' ILE . 25.2 m -103.84 -50.87 3.29 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.312 1.045 . . . . 0.0 111.388 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.5 p -55.69 -35.65 66.27 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.648 1.179 . . . . 0.0 113.06 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -51.86 -49.24 63.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.56 1.144 . . . . 0.0 112.734 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.72 -44.72 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.564 0.746 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.08 -39.54 80.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 122.598 0.359 . . . . 0.0 110.113 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.9 -44.77 79.92 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.661 1.184 . . . . 0.0 113.371 174.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -55.68 -31.5 62.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.419 0.688 . . . . 0.0 112.744 177.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -65.96 -47.31 75.04 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.264 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.77 -37.67 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.445 -1.409 . . . . 0.0 111.117 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -68.14 -4.55 14.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.682 1.193 . . . . 0.0 113.707 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.94 -10.98 2.02 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 m -151.97 -29.51 0.17 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.741 1.217 . . . . 0.0 112.812 -169.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 62' ' ' ALA . . . -71.97 -125.13 0.07 OUTLIER Glycine 0 CA--C 1.53 0.98 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 159.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.67 124.05 0.04 OUTLIER Glycine 0 CA--C 1.537 1.416 0 C-N-CA 126.536 2.017 . . . . 0.0 113.619 -166.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -56.24 -41.71 71.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 120.781 -1.423 . . . . 0.0 113.135 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.23 -31.22 62.52 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.15 -0.969 . . . . 0.0 112.736 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 58' ' ' GLY . . . -69.63 -41.57 75.46 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.706 1.203 . . . . 0.0 112.556 176.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.5 t -72.55 -26.71 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.026 1.331 . . . . 0.0 112.173 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -30.56 71.6 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 170.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 C--O 1.254 1.324 0 C-N-CA 124.991 1.317 . . . . 0.0 113.499 -173.786 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 112.443 -0.263 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 47.21 48.65 15.9 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.452 1.901 . . . . 0.0 114.008 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -57.0 -22.67 40.25 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.914 2.086 . . . . 0.0 115.245 -175.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 30.1 mtm -140.78 138.18 33.91 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.84 1.656 . . . . 0.0 110.357 172.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -134.88 5.99 3.38 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.525 1.53 . . . . 0.0 113.955 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -38.22 84.8 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.98 0.809 . . . . 0.0 112.088 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -158.65 132.4 7.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.174 0.99 . . . . 0.0 111.451 166.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 39.5 mtmt -139.0 166.42 24.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.892 1.677 . . . . 0.0 111.253 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 33.2 m -136.64 153.62 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.855 1.262 . . . . 0.0 110.995 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -102.58 125.98 49.49 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 124.519 1.127 . . . . 0.0 108.261 166.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 18.7 p -71.21 137.05 48.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.92 1.98 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.433 1.093 . . . . 0.0 111.654 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -154.02 154.24 29.65 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.227 1.811 . . . . 0.0 110.94 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -73.8 164.49 34.55 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.615 2.877 . . . . 0.0 113.055 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -145.74 148.47 33.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.994 1.318 . . . . 0.0 111.301 172.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 36.3 m -125.65 95.92 4.61 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.369 1.468 . . . . 0.0 110.466 -171.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.52 -30.39 71.43 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.169 1.388 . . . . 0.0 114.69 -177.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 61.89 -144.37 48.97 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 121.344 -0.847 . . . . 0.0 112.96 -171.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 73.6 p -69.37 -12.47 61.68 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -66.39 120.41 13.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.32 1.048 . . . . 0.0 112.584 -178.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 4.52 20.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.432 1.493 . . . . 0.0 114.635 179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 37.4 p -118.93 12.75 12.93 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.269 1.828 . . . . 0.0 111.978 -179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -116.35 158.39 23.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.978 1.311 . . . . 0.0 112.084 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp -123.37 135.25 54.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.664 1.586 . . . . 0.0 110.495 -176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -124.6 150.84 45.53 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.678 1.591 . . . . 0.0 112.32 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -170.09 -178.66 2.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.939 1.695 . . . . 0.0 111.377 -169.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -117.65 168.4 10.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.847 1.659 . . . . 0.0 111.521 172.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -55.97 138.01 49.7 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.829 -1.169 . . . . 0.0 111.884 172.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.59 -4.12 79.23 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.213 1.387 . . . . 0.0 114.072 177.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.76 155.52 29.28 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.076 0.938 . . . . 0.0 111.896 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 92.8 t -119.41 133.28 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.242 1.417 . . . . 0.0 110.721 -171.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 10.9 mm -128.57 133.69 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.114 1.366 . . . . 0.0 109.22 -175.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 11.9 m -95.1 125.03 39.47 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.422 1.089 . . . . 0.0 109.72 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.3 138.31 55.37 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.459 0.572 . . . . 0.0 111.162 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -111.84 -1.12 15.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.475 1.51 . . . . 0.0 112.548 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 47.3 pt -128.89 154.91 80.2 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.209 1.804 . . . . 0.0 110.643 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -74.91 -25.64 11.87 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.327 2.685 . . . . 0.0 114.726 -176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -155.37 157.82 37.7 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.156 1.382 . . . . 0.0 112.302 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' B' ' 109' ' ' LEU . 3.2 pm0 -77.67 170.33 16.75 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.581 1.153 . . . . 0.0 113.809 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.35 118.94 6.95 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -177.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 13.8 t0 55.25 25.05 6.94 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.526 -1.359 . . . . 0.0 114.184 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.46 6.53 80.91 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.489 1.518 . . . . 0.0 115.705 -171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -92.14 143.12 26.76 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.008 1.323 . . . . 0.0 110.54 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 104' ' ' GLU . 17.7 mt -129.66 146.12 51.47 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.405 1.882 . . . . 0.0 110.201 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -115.97 134.57 54.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 122.17 0.986 . . . . 0.0 110.157 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . -163.21 -174.72 33.43 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.273 -171.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -133.43 129.21 36.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.578 1.551 . . . . 0.0 109.552 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' HIS . . . . . 0.451 ' CE1' HG22 ' B' ' 115' ' ' VAL . 2.3 t-80 -67.23 130.03 41.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.9 0.88 . . . . 0.0 112.828 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -72.75 0.93 9.5 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' B' ' 113' ' ' HIS . 2.4 m -128.82 -19.92 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.03 1.332 . . . . 0.0 113.683 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 34.8 t -132.03 -4.82 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.156 1.782 . . . . 0.0 112.008 -170.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp 50.74 11.34 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.174 2.189 . . . . 0.0 115.014 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.78 136.31 54.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.241 1.416 . . . . 0.0 108.962 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -120.94 152.06 38.96 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.898 1.279 . . . . 0.0 111.321 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 159.34 170.18 23.58 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.323 0.963 . . . . 0.0 111.912 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -71.35 128.93 37.51 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 170.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . 0.423 ' CE1' HG21 ' B' ' 127' ' ' THR . 30.5 p90 -118.4 152.3 50.7 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.001 1.32 . . . . 0.0 111.419 171.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' PRO . . . . . 0.405 ' HB3' ' HD2' ' C' ' 168' ' ' PRO . 72.2 Cg_endo -74.32 119.19 5.67 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.194 2.596 . . . . 0.0 113.17 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.466 ' HB2' ' CD1' ' B' ' 109' ' ' LEU . 27.3 t -54.85 -40.74 69.97 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.743 1.217 . . . . 0.0 113.183 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 15.1 m -63.91 -26.65 68.7 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -81.7 5.85 17.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.529 1.132 . . . . 0.0 113.473 170.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.423 HG21 ' CE1' ' B' ' 122' ' ' PHE . 18.9 p -133.95 170.68 15.26 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.974 1.31 . . . . 0.0 112.731 -178.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -152.66 155.82 38.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.312 1.445 . . . . 0.0 111.002 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.4 mp -59.72 159.41 8.77 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.819 0.818 . . . . 0.0 112.408 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 16.7 mt -107.56 16.48 23.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.376 1.47 . . . . 0.0 112.204 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -56.64 145.47 28.52 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.619 0.768 . . . . 0.0 112.87 166.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.488 1.435 0 C-N-CA 127.328 2.251 . . . . 0.0 115.001 -173.315 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 117.352 -1.309 . . . . 0.0 113.122 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.5 -35.64 22.44 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.05 1.834 . . . . 0.0 113.721 -164.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 135' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -70.23 -36.06 74.27 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.007 -0.433 . . . . 0.0 111.623 174.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 136' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.26 -41.67 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.281 -0.887 . . . . 0.0 111.475 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.49 68.52 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.872 -1.143 . . . . 0.0 113.209 175.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 138' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.2 -26.44 63.88 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.565 -0.709 . . . . 0.0 112.072 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -100.76 -22.52 14.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.893 2.077 . . . . 0.0 113.308 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.619 HD22 HD11 ' A' ' 30' ' ' LEU . 64.3 tp -60.06 -47.74 84.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.535 0.607 . . . . 0.0 111.748 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 141' ' ' MET . . . . . . . . . . . . . 38.0 mtt -59.11 -34.47 72.07 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -176.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -64.76 -40.99 96.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.265 1.026 . . . . 0.0 112.396 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 143' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -65.69 -49.39 68.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.719 0.69 . . . . 0.0 112.349 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 mt -61.7 -30.86 71.02 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.884 -0.51 . . . . 0.0 112.033 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.83 -20.95 66.03 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.575 1.15 . . . . 0.0 113.289 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -78.66 -20.79 49.42 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.44 1.496 . . . . 0.0 112.376 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -115.6 -4.57 12.22 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.443 1.897 . . . . 0.0 112.208 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 148' ' ' GLY . . . . . . . . . . . . . . . 74.13 11.06 81.78 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 -173.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 149' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 46' ' ' THR . 31.8 mm -64.17 155.43 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 O-C-N 120.742 -1.446 . . . . 0.0 110.09 171.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -152.77 152.79 29.17 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 126.202 1.801 . . . . 0.0 110.276 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 151' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.41 161.44 43.26 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.697 2.265 . . . . 0.0 111.877 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.89 62.27 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.961 -1.087 . . . . 0.0 112.718 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -70.84 1.04 5.98 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.962 1.305 . . . . 0.0 113.84 165.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 154' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -116.54 16.25 15.55 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.582 1.553 . . . . 0.0 113.79 175.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 155' ' ' MET . . . . . . . . . . . . . 20.1 mtt -70.76 -173.75 0.81 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.973 0.909 . . . . 0.0 112.249 167.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 156' ' ' ALA . . . . . . . . . . . . . . . -51.69 126.73 18.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.968 1.307 . . . . 0.0 113.758 -178.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -143.36 -55.78 0.4 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.889 1.276 . . . . 0.0 112.109 -173.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 158' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.77 175.81 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.006 2.122 . . . . 0.0 110.44 -172.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 159' ' ' ILE . . . . . . . . . . . . . 19.4 mm -112.29 134.84 21.43 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.444 1.097 . . . . 0.0 109.647 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 160' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -66.58 172.63 8.99 Favored 'Trans proline' 0 CA--C 1.548 1.218 1 C-N-CA 125.575 4.183 . . . . 0.0 114.038 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.25 -81.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 123.741 2.961 . . . . 0.0 113.489 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 162' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' C' ' 163' ' ' PRO . . . 157.77 162.09 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.838 2.855 . . . . 0.0 112.389 -174.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 163' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' C' ' 162' ' ' ALA . 73.1 Cg_endo -70.53 171.41 15.37 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.915 3.077 . . . . 0.0 113.587 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -89.54 7.49 36.01 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.354 1.462 . . . . 0.0 114.316 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 165' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -139.08 158.26 69.83 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.66 1.584 . . . . 0.0 111.234 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 166' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -71.2 158.14 55.52 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.448 2.098 . . . . 0.0 113.25 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.92 130.75 91.3 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 168' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' B' ' 123' ' ' PRO . 47.9 Cg_endo -66.41 162.96 34.16 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.909 3.072 . . . . 0.0 112.855 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 169' ' ' THR . . . . . . . . . . . . . 12.6 p -120.45 151.53 53.92 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.189 1.396 . . . . 0.0 112.773 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 170' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.84 168.83 19.17 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 124.426 3.417 . . . . 0.0 114.07 -176.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 171' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.11 75.59 2.27 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 124.848 3.699 . . . . 0.0 111.438 174.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . 12.3 p -143.2 145.56 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.903 1.281 . . . . 0.0 110.921 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 173' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 50.86 26.2 2.52 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.671 1.588 . . . . 0.0 114.253 -174.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 174' ' ' ASN . . . . . . . . . . . . . 49.9 p30 -148.87 179.42 7.87 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.255 1.822 . . . . 0.0 112.074 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 175' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -144.95 141.55 29.09 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.139 1.376 . . . . 0.0 110.208 175.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 176' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -141.68 174.06 10.92 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.201 1.401 . . . . 0.0 112.096 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 177' ' ' SER . . . . . . . . . . . . . 2.9 t -121.75 30.26 6.76 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.814 1.646 . . . . 0.0 111.836 -178.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 50.1 mmm-85 -132.77 57.05 25.63 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 126.906 2.083 . . . . 0.0 111.611 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 179' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.007 3.138 . . . . 0.0 113.36 -179.167 . . . . . . . . 0 0 . 1 stop_ save_