data_6kh8_residue ############################ # Computer software used # ############################ 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 6kh8 _Structure_validation_residue.Date_analyzed 2020-10-09 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 ' 1' ' ' GLY . . . . . 0.517 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.538 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.538 ' NE2' ' H ' ' A' ' 12' ' ' SER . 19.9 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.517 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.418 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.418 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.567 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.443 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.443 ' NE2' ' H ' ' A' ' 12' ' ' SER . 17.8 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.567 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt . . . . . 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.573 ' CD1' ' HH ' ' B' ' 26' ' ' TYR . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . 0.573 ' HH ' ' CD1' ' B' ' 15' ' ' LEU . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt . . . . . 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 m120 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HB2' HE21 ' A' ' 15' ' ' GLN . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.453 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 11' ' ' CYS . 27.3 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.435 HD22 ' C ' ' A' ' 21' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.407 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.407 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.466 ' H3 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.466 ' CD ' ' H3 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.475 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 12' ' ' SER . 26.7 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . 0.403 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . 0.403 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.538 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.538 ' NE2' ' H ' ' A' ' 12' ' ' SER . 19.9 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.517 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.418 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.418 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -146.79 171.58 14.95 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.916 0 O-C-N 124.693 1.246 . . . . 0.0 107.747 142.593 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.567 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.443 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.443 ' NE2' ' H ' ' A' ' 12' ' ' SER . 17.8 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.567 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.42 -160.8 1.1 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.008 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 127.402 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.437 ' H ' ' C ' ' B' ' 30' ' ' ALA . 42.4 mtmt -138.58 -49.08 0.53 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' B' ' 29' ' ' LYS . . . . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 115.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' B' ' 30' ' ' ALA . 17.9 mtmt -126.85 -56.95 1.35 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.486 ' C ' ' H ' ' B' ' 29' ' ' LYS . . . . . . . . 0 C--O 1.242 0.699 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 113.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' B' ' 30' ' ' ALA . 52.1 mtmt -139.48 -46.99 0.46 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.41 ' C ' ' H ' ' B' ' 29' ' ' LYS . . . . . . . . 0 C--O 1.242 0.689 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 117.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.573 ' CD1' ' HH ' ' B' ' 26' ' ' TYR . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . 0.573 ' HH ' ' CD1' ' B' ' 15' ' ' LEU . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -143.29 -49.68 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 117.016 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 m120 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -139.49 30.51 2.13 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 1 C-N-CA 132.297 4.239 . . . . 0.0 106.479 173.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HB2' HE21 ' A' ' 15' ' ' GLN . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.453 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 11' ' ' CYS . 27.3 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.435 HD22 ' C ' ' A' ' 21' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.506 ' HZ1' ' C ' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -164.09 161.24 22.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.506 ' C ' ' HZ1' ' B' ' 29' ' ' LYS . . . . . . . . 0 C--O 1.249 1.033 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 133.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.407 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.407 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -167.93 163.79 13.82 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.88 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.112 155.131 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.466 ' H3 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.466 ' CD ' ' H3 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.475 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 12' ' ' SER . 26.7 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . 0.403 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.403 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.422 ' HG2' ' H ' ' B' ' 30' ' ' ALA . 1.1 ttmp? -164.56 172.2 13.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.422 ' H ' ' HG2' ' B' ' 29' ' ' LYS . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.343 150.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.54 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.54 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.573 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.573 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.49 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt . . . . . 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.46 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt . . . . . 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.43 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.404 ' C ' HH21 ' B' ' 22' ' ' ARG . 36.1 t-20 . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.404 HH21 ' C ' ' A' ' 21' ' ' ASN . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.473 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.473 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' PHE . . . . . 0.413 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' VAL . . . . . 0.413 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.54 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.54 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -146.79 171.58 14.95 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.916 0 O-C-N 124.693 1.246 . . . . 0.0 107.747 142.593 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.573 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.573 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.42 -160.8 1.1 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.008 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 127.402 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -138.58 -49.08 0.53 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 115.355 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.49 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -126.85 -56.95 1.35 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.699 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 113.073 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -139.48 -46.99 0.46 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.689 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 117.25 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.46 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -143.29 -49.68 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 117.016 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -139.49 30.51 2.13 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 1 C-N-CA 132.297 4.239 . . . . 0.0 106.479 173.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.43 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.404 ' C ' HH21 ' B' ' 22' ' ' ARG . 36.1 t-20 . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.404 HH21 ' C ' ' A' ' 21' ' ' ASN . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.09 161.24 22.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 133.584 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -167.93 163.79 13.82 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.88 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.112 155.131 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.473 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.473 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' PHE . . . . . 0.413 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.413 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -164.56 172.2 13.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.343 150.275 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.54 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.561 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.561 ' NE2' ' H ' ' A' ' 12' ' ' SER . 19.9 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.54 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.573 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.457 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.457 ' NE2' ' H ' ' A' ' 12' ' ' SER . 17.8 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.573 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.49 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt . . . . . 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.46 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.509 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt . . . . . 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 m120 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HB2' HE22 ' A' ' 15' ' ' GLN . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.43 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.416 HE22 ' HB2' ' A' ' 11' ' ' CYS . 27.3 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.433 ' C ' HD22 ' A' ' 21' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.404 HH21 ' C ' ' A' ' 21' ' ' ASN . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.473 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.473 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.528 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.528 ' NE2' ' H ' ' A' ' 12' ' ' SER . 26.7 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . 0.413 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . 0.413 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.54 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 116.017 -2.546 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.0 tt -80.07 8.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 126.195 1.798 . . . . 0.0 114.377 -172.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.6 -17.1 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 O-C-N 120.303 -1.498 . . . . 0.0 112.845 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.269 -0.895 . . . . 0.0 112.51 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.46 -34.49 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.979 -1.075 . . . . 0.0 111.978 169.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.0 m -70.52 -15.82 62.83 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.4 m -85.97 -10.74 54.63 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 113.428 174.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -141.12 1.48 1.63 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -171.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -159.52 170.73 21.06 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.434 -1.417 . . . . 0.0 111.601 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.3 t -64.43 91.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.617 1.167 . . . . 0.0 111.23 -174.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.3 t -55.28 132.6 48.26 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.541 1.136 . . . . 0.0 112.19 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.561 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 47.7 t -136.77 153.82 50.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.923 1.689 . . . . 0.0 112.559 -173.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.01 -32.2 68.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.58 1.552 . . . . 0.0 114.148 -166.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -57.0 -26.79 60.85 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.561 ' NE2' ' H ' ' A' ' 12' ' ' SER . 19.9 mt-30 -66.0 -26.28 67.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.923 0.889 . . . . 0.0 112.513 172.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.83 -49.84 8.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.542 1.137 . . . . 0.0 110.391 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -57.47 -45.28 85.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.843 0.857 . . . . 0.0 112.134 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -66.51 5.56 0.57 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.414 1.486 . . . . 0.0 114.263 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.54 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 12.9 m-85 -124.93 5.53 8.01 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.307 1.843 . . . . 0.0 114.172 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.01 -176.83 3.02 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.9 m120 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 128.517 2.727 . . . . 0.0 106.447 165.271 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.5 t80 . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.91 161.14 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 118.764 0.711 . . . . 0.0 109.14 146.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -71.41 -10.64 60.08 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.786 1.634 . . . . 0.0 115.256 -165.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -148.96 144.85 27.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.247 1.419 . . . . 0.0 111.124 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -80.7 42.63 0.63 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.012 1.325 . . . . 0.0 113.382 -170.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.15 126.18 30.49 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.901 1.281 . . . . 0.0 109.37 -176.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -78.92 126.98 31.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.354 1.062 . . . . 0.0 112.844 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 169.06 178.28 40.36 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 116.211 1.244 . . . . 0.0 116.211 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 47.2 m -65.04 -3.96 4.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -57.35 -30.94 65.24 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.943 1.297 . . . . 0.0 112.602 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.57 -15.75 58.2 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.132 -0.98 . . . . 0.0 113.285 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 t -82.71 -35.96 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.694 1.598 . . . . 0.0 111.386 164.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -58.84 -40.58 84.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.318 0.963 . . . . 0.0 110.187 164.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.13 79.3 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' B' ' 24' ' ' PHE . 5.9 mt -66.58 -32.26 73.48 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.56 -0.712 . . . . 0.0 112.101 171.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -69.55 -35.58 75.54 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.586 -1.321 . . . . 0.0 112.536 167.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.7 mt -72.66 3.05 5.44 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.545 1.538 . . . . 0.0 114.383 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -127.6 -59.77 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.616 1.566 . . . . 0.0 111.437 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 t -97.05 -36.58 10.46 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.832 0.853 . . . . 0.0 112.934 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -89.86 0.08 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 126.063 1.792 . . . . 0.0 115.589 166.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.8 -34.75 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.73 2.412 . . . . 0.0 114.734 -163.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.92 -0.25 55.75 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.07 -154.53 49.76 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -157.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' B' ' 15' ' ' LEU . 2.7 m-85 -131.9 139.98 48.92 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.644 1.222 . . . . 0.0 111.307 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -73.32 -49.59 26.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 58.75 166.21 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.352 2.723 . . . . 0.0 118.352 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.6 p -142.88 151.5 56.54 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 126.123 1.769 . . . . 0.0 110.436 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.89 -168.03 5.09 Favored 'Cis proline' 0 CA--C 1.547 1.126 0 CA-C-N 120.333 1.155 . . . . 0.0 113.31 -2.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -146.79 171.58 14.95 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.324 1.849 . . . . 0.0 110.182 174.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.916 0 O-C-N 124.693 1.246 . . . . 0.0 107.747 142.593 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.573 ' HA2' ' CE1' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.47 0.938 0 CA-C-O 117.282 -1.843 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.64 -9.64 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 118.863 1.331 . . . . 0.0 113.971 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.79 -19.37 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 172.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -61.84 -34.27 75.65 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 121.185 1.811 . . . . 0.0 112.446 173.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -61.27 -41.1 96.35 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 122.29 1.043 . . . . 0.0 110.357 171.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.3 m -73.3 -12.71 60.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -85.69 -4.26 59.11 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.241 1.416 . . . . 0.0 112.774 168.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.74 3.06 1.83 Allowed 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -174.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 m -159.78 165.99 31.29 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.93 1.292 . . . . 0.0 111.637 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.4 t -64.71 86.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 125.093 1.357 . . . . 0.0 111.413 -174.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.19 130.05 40.62 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.055 0.942 . . . . 0.0 112.421 -169.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.457 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 73.1 m -140.63 156.91 46.13 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.837 0.855 . . . . 0.0 113.241 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.67 -25.82 68.11 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -150.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -56.27 -30.29 62.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.457 ' NE2' ' H ' ' A' ' 12' ' ' SER . 17.8 mt-30 -71.43 -22.39 61.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 112.902 173.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 mt -89.19 -38.56 14.18 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 111.165 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -51.49 -45.27 62.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 122.1 0.953 . . . . 0.0 111.556 168.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.95 -16.4 12.14 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.386 1.874 . . . . 0.0 114.851 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.573 ' CE1' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -115.77 2.48 13.65 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -167.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.34 -169.95 2.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -161.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 C--O 1.254 1.33 0 C-N-CA 127.274 2.23 . . . . 0.0 111.119 179.099 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 116.779 -1.581 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.34 152.44 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 119.75 1.159 . . . . 0.0 109.239 149.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -75.32 13.37 0.74 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.605 1.562 . . . . 0.0 115.153 -168.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -147.43 166.5 27.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.806 0.842 . . . . 0.0 112.907 -164.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.27 26.47 2.9 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.785 2.034 . . . . 0.0 114.059 -166.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -87.27 110.07 19.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.177 0.989 . . . . 0.0 112.304 -156.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -60.76 149.05 36.86 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.962 2.505 . . . . 0.0 114.946 -174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.72 -139.51 14.46 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 124.553 1.073 . . . . 0.0 115.269 166.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -62.39 -25.02 67.71 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -164.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -58.64 -26.99 64.31 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.521 1.055 . . . . 0.0 112.595 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.8 -21.89 34.38 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.079 -1.013 . . . . 0.0 112.761 175.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.89 -38.31 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.884 1.674 . . . . 0.0 111.241 167.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -64.18 -40.94 97.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.781 0.832 . . . . 0.0 111.322 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.69 -25.84 68.39 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 170.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.09 -37.32 64.23 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.396 0.998 . . . . 0.0 111.951 168.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -60.95 -31.38 70.93 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.572 -1.33 . . . . 0.0 112.776 171.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.15 2.44 13.03 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -137.27 -46.99 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.977 1.311 . . . . 0.0 112.628 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 27.6 t -111.63 -48.15 3.1 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.555 1.542 . . . . 0.0 112.468 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 29.72 -90.65 0.01 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 127.83 2.633 . . . . 0.0 116.4 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -36.86 -45.43 0.55 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 130.078 3.351 . . . . 0.0 115.034 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -8.54 56.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -173.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.8 155.49 10.39 Favored Glycine 0 CA--C 1.539 1.57 0 CA-C-O 122.391 0.995 . . . . 0.0 114.939 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -99.36 112.18 24.41 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.279 -1.13 . . . . 0.0 111.008 -169.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.02 -36.26 66.96 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 t80 48.02 79.7 0.06 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 117.587 2.44 . . . . 0.0 117.587 155.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.2 p -76.0 157.3 83.6 Favored Pre-proline 0 N--CA 1.484 1.226 0 O-C-N 120.162 -1.586 . . . . 0.0 114.087 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -84.76 157.86 66.35 Favored 'Cis proline' 0 C--N 1.353 0.806 0 CA-C-N 119.678 0.921 . . . . 0.0 114.348 -3.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.42 -160.8 1.1 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.245 2.218 . . . . 0.0 106.009 163.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.008 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 127.402 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.176 0 CA-C-O 116.926 -2.041 . . . . 0.0 108.91 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.98 -8.09 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.83 -18.59 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -162.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.23 -31.33 68.96 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.6 -1.312 . . . . 0.0 112.951 169.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -72.96 -2.39 20.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.084 1.354 . . . . 0.0 113.796 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.9 m -97.17 -21.14 17.49 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.317 1.047 . . . . 0.0 113.436 163.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.6 m -90.61 -13.28 34.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.912 1.285 . . . . 0.0 112.789 -177.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.22 -145.51 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.104 1.362 . . . . 0.0 111.094 156.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -59.58 101.99 0.13 Allowed 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.324 -1.485 . . . . 0.0 111.35 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 t -50.64 112.41 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -154.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.5 p -45.52 167.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.047 3.339 . . . . 0.0 118.09 -168.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 t -108.31 164.75 12.05 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.726 1.211 . . . . 0.0 111.235 163.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -59.27 -25.05 63.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.736 2.014 . . . . 0.0 115.243 -163.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -31.78 67.45 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.553 1.141 . . . . 0.0 112.94 -175.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -63.11 -32.34 73.69 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.664 0.786 . . . . 0.0 112.747 173.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.8 mt -84.15 -40.32 18.35 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.384 1.474 . . . . 0.0 109.94 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.48 -38.51 69.22 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.717 1.207 . . . . 0.0 111.18 171.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -5.7 2.01 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.642 1.977 . . . . 0.0 114.53 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -126.34 2.92 7.03 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -168.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -84.53 -178.74 6.98 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.875 1.27 . . . . 0.0 114.187 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--O 1.247 0.933 0 C-N-CA 125.986 1.714 . . . . 0.0 110.966 164.507 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.9 t80 . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 117.739 -1.124 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.04 160.18 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 123.711 0.632 . . . . 0.0 109.745 161.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -78.79 -7.81 58.17 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.648 1.722 . . . . 0.0 115.648 -160.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -127.25 142.66 51.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.886 1.221 . . . . 0.0 113.858 -172.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -76.21 -10.18 59.21 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.785 1.634 . . . . 0.0 113.5 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -60.14 108.31 0.77 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.567 1.147 . . . . 0.0 109.992 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -73.98 130.62 40.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.07 1.348 . . . . 0.0 112.215 -168.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.44 -162.87 36.49 Favored Glycine 0 CA--C 1.527 0.801 0 CA-C-O 122.014 0.786 . . . . 0.0 114.711 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -57.82 -16.81 12.78 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -177.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -57.63 -28.83 64.05 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.38 1.446 . . . . 0.0 113.271 173.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.74 -19.46 44.92 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.271 -0.893 . . . . 0.0 113.091 172.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.4 t -79.84 -34.97 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.688 1.195 . . . . 0.0 110.843 167.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -64.65 -37.53 87.88 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.906 -1.121 . . . . 0.0 111.071 167.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.55 81.71 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 120.64 -1.287 . . . . 0.0 113.871 166.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -62.39 -42.05 99.12 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.656 1.116 . . . . 0.0 112.262 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -61.44 -37.53 83.88 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.114 0.87 . . . . 0.0 112.216 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -69.94 -16.59 63.23 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 173.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 t -97.78 -28.28 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.124 1.37 . . . . 0.0 113.652 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t -142.0 -23.93 0.69 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.56 -94.65 0.06 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.338 1.447 . . . . 0.0 115.89 171.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -64.2 -26.58 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.084 2.154 . . . . 0.0 115.708 -157.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtp180 -105.74 -1.55 24.3 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -165.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.13 -164.87 31.77 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-O 121.552 0.529 . . . . 0.0 113.272 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -132.89 132.32 41.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.6 -0.941 . . . . 0.0 110.101 -169.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -68.42 -45.3 72.97 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.617 -0.677 . . . . 0.0 111.97 -173.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 54.88 106.88 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.341 1.856 . . . . 0.0 114.464 -168.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 28.0 p -82.59 150.48 63.12 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.828 0.851 . . . . 0.0 110.15 163.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.71 132.37 18.78 Favored 'Cis proline' 0 CA--C 1.54 0.798 0 CA-C-N 120.644 1.266 . . . . 0.0 114.323 1.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -138.58 -49.08 0.53 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 128.287 2.635 . . . . 0.0 107.773 154.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 115.355 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.136 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.4 tt -57.81 -12.16 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -152.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 p -52.53 -20.7 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.243 -0.91 . . . . 0.0 112.335 161.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.81 -34.48 53.95 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.576 1.08 . . . . 0.0 113.066 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -73.5 -18.44 61.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.398 -1.439 . . . . 0.0 113.664 172.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.7 m -87.23 -10.63 52.02 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.815 0.846 . . . . 0.0 112.919 170.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.9 m -80.18 32.21 0.28 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.044 1.338 . . . . 0.0 110.85 163.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.81 -157.85 0.46 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.735 2.414 . . . . 0.0 110.228 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -62.74 80.35 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.505 1.922 . . . . 0.0 116.147 -167.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t 57.58 41.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 125.679 1.592 . . . . 0.0 114.362 157.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -39.96 154.88 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 128.018 2.527 . . . . 0.0 117.66 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -104.56 155.62 18.67 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 114.727 1.381 . . . . 0.0 114.727 -173.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.49 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -52.4 -42.58 64.16 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.373 1.869 . . . . 0.0 114.329 -165.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -54.2 -30.67 50.59 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -69.04 -19.26 64.1 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.639 1.175 . . . . 0.0 111.807 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.6 mt -91.98 -44.99 8.57 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.13 1.372 . . . . 0.0 111.164 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -53.84 -40.71 66.7 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.277 1.031 . . . . 0.0 111.959 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -69.81 7.47 0.89 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.985 2.114 . . . . 0.0 114.34 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -129.17 -8.49 4.8 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.439 1.496 . . . . 0.0 113.836 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 t -71.87 175.96 5.37 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.593 0.757 . . . . 0.0 110.908 155.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 116.751 -1.595 . . . . 0.0 111.221 174.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 117.431 -1.271 . . . . 0.0 108.924 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.2 p -62.27 157.5 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 118.767 0.712 . . . . 0.0 109.605 164.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -82.91 1.67 38.35 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 -164.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 10.4 pm0 -145.3 140.22 27.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.217 1.407 . . . . 0.0 111.162 -171.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -74.65 30.95 0.09 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.015 1.726 . . . . 0.0 113.926 -175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -81.91 88.24 6.37 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.409 -1.432 . . . . 0.0 111.166 -168.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.2 t -42.49 135.5 2.72 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.528 2.331 . . . . 0.0 114.597 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.25 -94.79 1.27 Allowed Glycine 0 CA--C 1.533 1.179 0 O-C-N 121.342 -0.849 . . . . 0.0 113.895 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 32.5 m -63.7 -43.54 96.3 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -160.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -62.18 -21.84 65.42 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.231 0.923 . . . . 0.0 112.561 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.62 -27.55 22.44 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.133 0.973 . . . . 0.0 112.787 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.3 t -63.09 -41.68 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.476 1.034 . . . . 0.0 109.912 164.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.19 -46.31 84.48 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.613 -0.679 . . . . 0.0 111.52 170.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -32.68 71.08 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.432 -1.418 . . . . 0.0 113.795 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.4 mt -63.94 -36.34 83.62 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.37 1.068 . . . . 0.0 112.146 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.85 -38.67 89.46 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 120.966 -1.084 . . . . 0.0 112.745 169.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.0 mt -66.64 -27.29 67.57 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.845 0.748 . . . . 0.0 112.617 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.7 t -84.16 -33.03 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.321 1.448 . . . . 0.0 113.574 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -142.18 -6.5 0.94 Allowed 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.053 2.242 . . . . 0.0 117.053 -167.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.51 -120.05 18.09 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.959 1.266 . . . . 0.0 115.636 170.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -56.65 -33.1 66.02 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.733 2.413 . . . . 0.0 115.572 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -70.2 -19.73 63.15 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.66 1.584 . . . . 0.0 115.154 -164.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.3 -171.55 28.36 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 122.103 -0.373 . . . . 0.0 113.011 -167.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -127.57 134.58 49.71 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.637 -0.92 . . . . 0.0 110.453 -168.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -77.61 -46.61 21.6 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.25 -174.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 57.64 113.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.388 1.875 . . . . 0.0 114.947 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 72.0 p -101.49 152.41 38.02 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.725 1.21 . . . . 0.0 112.014 173.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -88.81 145.79 22.53 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 N-CA-C 113.989 0.727 . . . . 0.0 113.989 -3.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -126.85 -56.95 1.35 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.252 1.821 . . . . 0.0 107.182 148.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.699 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 113.073 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.7 tt -48.74 0.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 120.964 3.69 . . . . 0.0 120.964 -129.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -61.18 -17.61 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 121.05 1.75 . . . . 0.0 113.643 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.53 -42.52 64.45 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.621 1.169 . . . . 0.0 112.595 163.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.7 mm100 -70.66 0.21 7.42 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.219 1.408 . . . . 0.0 114.054 172.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -115.53 20.68 14.57 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.415 1.886 . . . . 0.0 112.45 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -103.99 29.48 5.86 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.772 1.629 . . . . 0.0 110.413 156.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.91 169.45 21.13 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.134 2.174 . . . . 0.0 111.941 -168.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -58.17 122.65 13.64 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -165.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t 51.71 38.81 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.712 1.605 . . . . 0.0 113.16 165.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.16 147.22 7.84 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 120.788 -1.195 . . . . 0.0 113.712 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.0 m -139.39 160.96 38.61 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 117.399 2.37 . . . . 0.0 117.399 -161.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.0 mt -45.04 -41.66 7.75 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.982 2.216 . . . . 0.0 116.982 -153.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -55.42 -28.89 57.07 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.282 1.401 . . . . 0.0 114.351 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -72.69 -17.69 61.61 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.332 1.053 . . . . 0.0 112.615 174.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -95.16 -50.78 4.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.239 1.416 . . . . 0.0 110.761 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -51.47 -43.08 62.03 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -68.51 6.5 0.8 Allowed 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -133.31 8.71 4.0 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -173.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.0 t -136.35 144.25 44.51 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.653 1.115 . . . . 0.0 111.012 167.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.479 -165.365 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 11.1 t80 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.92 166.73 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 118.901 0.773 . . . . 0.0 109.427 155.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -80.69 -35.97 32.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.985 1.714 . . . . 0.0 113.821 -170.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.8 pm0 -107.27 151.03 26.01 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.837 1.255 . . . . 0.0 113.462 -168.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -98.21 33.65 2.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.706 1.203 . . . . 0.0 111.968 -167.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -79.58 97.17 6.38 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.631 -162.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -43.53 115.8 0.84 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.807 1.643 . . . . 0.0 114.121 -164.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.82 -77.01 1.33 Allowed Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.353 0.977 . . . . 0.0 113.508 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 4.7 t -52.54 -58.5 6.56 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -154.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 55.1 m170 -59.69 -16.67 28.56 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.54 -25.5 13.88 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.715 1.206 . . . . 0.0 111.799 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -64.16 -40.38 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.268 0.627 . . . . 0.0 109.606 158.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -65.58 -41.74 92.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.285 1.034 . . . . 0.0 111.779 171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.74 -32.92 74.57 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 120.354 -1.466 . . . . 0.0 113.284 170.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.98 -36.53 83.82 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.332 1.053 . . . . 0.0 112.244 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -62.86 -45.73 91.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.739 1.154 . . . . 0.0 111.79 166.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.76 -31.19 72.28 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.555 1.07 . . . . 0.0 113.137 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.0 t -78.65 -45.81 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.771 1.628 . . . . 0.0 111.732 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 26.6 t -98.04 -28.72 13.65 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -167.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.53 -109.4 2.88 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.353 0.977 . . . . 0.0 112.41 -170.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -73.92 -43.01 59.75 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -163.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.19 -21.33 59.87 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -147.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 156.91 22.76 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 115.803 1.081 . . . . 0.0 115.803 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.15 135.03 37.21 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.553 -0.969 . . . . 0.0 113.3 -161.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -79.79 -50.59 10.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.412 -0.804 . . . . 0.0 113.15 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 46.42 87.4 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.8 p -64.33 146.29 97.89 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.808 1.243 . . . . 0.0 111.365 165.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -88.05 128.97 9.46 Favored 'Cis proline' 0 CA--C 1.544 0.983 0 CA-C-N 119.932 1.011 . . . . 0.0 114.342 -0.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -139.48 -46.99 0.46 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 128.05 2.54 . . . . 0.0 108.808 155.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.689 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 117.25 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.46 ' HA2' ' CZ ' ' A' ' 19' ' ' TYR . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.6 tt -69.27 11.94 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 -161.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.7 p -60.0 -26.47 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 120.033 -1.667 . . . . 0.0 114.605 -165.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.02 -27.51 69.46 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.901 1.228 . . . . 0.0 114.043 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -69.22 -24.95 64.08 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.253 -1.529 . . . . 0.0 111.63 171.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.8 m -87.14 24.82 1.47 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.241 1.817 . . . . 0.0 112.823 167.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -130.02 -24.8 2.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 128.465 2.706 . . . . 0.0 111.394 166.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.22 -170.42 0.77 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.671 1.188 . . . . 0.0 112.255 154.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.6 m -54.42 129.76 36.94 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.083 1.353 . . . . 0.0 113.361 -176.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.1 t -16.89 106.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 128.637 2.775 . . . . 0.0 115.119 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.9 p -69.94 153.38 43.32 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.384 1.564 . . . . 0.0 114.206 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -83.32 158.2 22.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.413 1.485 . . . . 0.0 112.23 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.509 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -55.83 -44.29 77.79 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.962 0.905 . . . . 0.0 111.604 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.86 -29.82 63.25 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -72.67 -22.32 60.94 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.253 1.021 . . . . 0.0 111.926 177.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.7 mt -83.37 -54.35 5.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.481 1.112 . . . . 0.0 109.646 174.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -52.25 -33.49 41.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.007 1.723 . . . . 0.0 113.651 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -48.7 -18.21 0.24 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.902 1.681 . . . . 0.0 113.894 173.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CZ ' ' HA2' ' A' ' 1' ' ' GLY . 76.7 m-85 -126.16 5.3 7.12 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -63.34 144.13 57.22 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 120.247 1.385 . . . . 0.0 111.814 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 C--O 1.244 0.786 0 C-N-CA 124.865 1.266 . . . . 0.0 109.787 175.645 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.3 t80 . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.42 174.28 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 CA-C-N 118.897 0.771 . . . . 0.0 109.181 140.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -94.26 -9.13 37.1 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 pm0 -139.27 142.02 37.77 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.166 0.987 . . . . 0.0 113.457 -163.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -78.83 31.11 0.2 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.003 1.721 . . . . 0.0 112.934 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.06 102.65 6.59 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.297 -1.502 . . . . 0.0 110.936 -166.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -50.47 124.2 10.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -165.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.87 -78.91 0.74 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.112 0.863 . . . . 0.0 112.517 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 2.2 t -52.54 -57.39 10.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -157.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -64.35 -19.93 65.78 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -99.22 -23.92 15.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.307 1.043 . . . . 0.0 112.478 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.02 -46.58 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.294 1.438 . . . . 0.0 109.452 160.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -60.38 -45.22 94.33 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.294 1.437 . . . . 0.0 111.542 171.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.54 -38.51 77.94 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.947 -1.095 . . . . 0.0 112.112 171.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.53 -33.59 76.03 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -67.01 -33.0 74.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.446 1.475 . . . . 0.0 112.67 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -69.76 -20.25 63.5 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.314 0.961 . . . . 0.0 113.239 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.4 t -97.25 -50.27 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.261 1.024 . . . . 0.0 113.177 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -129.32 22.03 5.63 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.37 -8.27 24.08 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 117.48 1.752 . . . . 0.0 117.48 -173.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.95 -33.05 74.55 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 118.733 1.266 . . . . 0.0 112.451 168.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -121.65 -25.83 5.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.085 1.354 . . . . 0.0 113.764 176.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.73 -149.45 19.55 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.322 0.963 . . . . 0.0 112.531 -170.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -159.23 137.73 10.74 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.102 0.961 . . . . 0.0 112.616 -168.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -72.42 -49.73 31.5 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -159.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 50.71 90.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.408 1.483 . . . . 0.0 113.618 -171.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 44.0 p -62.92 155.42 72.05 Favored Pre-proline 0 N--CA 1.475 0.785 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.24 163.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -84.24 130.24 15.02 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 CA-C-N 121.748 1.66 . . . . 0.0 113.653 -1.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -143.29 -49.68 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 129.923 3.289 . . . . 0.0 107.379 158.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 117.016 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.307 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tt -159.61 -7.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.725 1.21 . . . . 0.0 113.873 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.3 -24.8 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.421 -1.425 . . . . 0.0 111.713 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pm0 -50.89 -29.71 12.68 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.099 2.159 . . . . 0.0 113.713 165.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -68.68 -32.78 72.86 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.888 -1.132 . . . . 0.0 113.232 170.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.8 m -76.78 -32.82 57.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.626 -0.671 . . . . 0.0 111.886 174.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.9 m -66.4 -3.5 6.19 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -152.96 12.15 0.49 Allowed 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.8 m -166.7 168.78 14.08 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 120.313 -1.492 . . . . 0.0 114.536 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.37 67.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 126.724 2.009 . . . . 0.0 111.76 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -58.1 143.04 45.13 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.06 -1.025 . . . . 0.0 111.59 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 m -150.75 155.28 38.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.593 1.157 . . . . 0.0 111.957 -166.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -50.1 -30.33 10.83 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 -151.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -52.99 -28.4 23.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.04 1.291 . . . . 0.0 113.225 171.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -85.04 -15.75 43.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.601 1.561 . . . . 0.0 113.402 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.8 mt -97.46 -51.49 4.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.017 1.727 . . . . 0.0 112.346 -173.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -51.66 -42.14 61.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.294 1.038 . . . . 0.0 111.421 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.22 7.07 0.63 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.42 2.288 . . . . 0.0 114.929 -175.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.97 0.31 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.32 1.448 . . . . 0.0 114.298 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.34 170.15 9.71 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.654 1.582 . . . . 0.0 112.799 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 m120 . . . . . 0 C--O 1.247 0.944 0 C-N-CA 126.788 2.035 . . . . 0.0 111.045 169.635 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 6.2 t80 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.98 162.5 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 O-C-N 123.868 0.73 . . . . 0.0 110.526 158.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -90.11 -31.01 17.29 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -115.9 142.95 46.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.784 1.234 . . . . 0.0 113.841 -169.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -93.57 19.75 8.17 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.666 1.986 . . . . 0.0 113.457 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -100.57 127.44 46.95 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.935 1.294 . . . . 0.0 110.272 -168.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.3 t -62.97 124.36 20.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.964 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.32 167.94 38.84 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.344 -0.847 . . . . 0.0 114.789 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -60.52 -20.87 61.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.756 0.823 . . . . 0.0 112.829 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -49.53 -28.77 5.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.904 1.681 . . . . 0.0 114.315 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.82 -16.77 21.65 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 176.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 t -70.06 -39.05 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 120.9 -1.125 . . . . 0.0 110.173 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.47 -38.14 86.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.03 0.932 . . . . 0.0 111.252 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -35.62 79.68 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.448 -1.407 . . . . 0.0 113.398 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.05 -37.06 78.35 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.619 1.1 . . . . 0.0 111.809 170.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -64.37 -26.5 68.49 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 120.323 -1.486 . . . . 0.0 112.861 172.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.46 -26.54 61.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.993 1.269 . . . . 0.0 112.968 169.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -78.03 -43.78 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.122 0.969 . . . . 0.0 112.003 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -128.71 -15.9 4.33 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.28 -113.97 1.97 Allowed Glycine 0 CA--C 1.534 1.271 0 CA-C-N 119.782 1.174 . . . . 0.0 114.325 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -54.84 -31.04 58.92 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.377 2.271 . . . . 0.0 114.492 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -67.67 -19.56 65.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.431 1.092 . . . . 0.0 113.502 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.35 -149.18 43.02 Favored Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.552 -0.718 . . . . 0.0 112.714 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -138.71 143.38 39.09 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.429 1.091 . . . . 0.0 111.129 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -71.73 -47.2 55.43 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.847 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 50.33 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.572 1.549 . . . . 0.0 114.983 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 71.1 p -71.51 149.33 93.53 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 123.584 0.754 . . . . 0.0 112.802 173.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -84.97 129.62 13.38 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 CA-C-N 118.667 0.56 . . . . 0.0 112.028 -11.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -139.49 30.51 2.13 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.22 1.808 . . . . 0.0 111.096 164.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 1 C-N-CA 132.297 4.239 . . . . 0.0 106.479 173.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.041 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.96 -6.24 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 -149.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -52.86 -22.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 O-C-N 121.361 -0.837 . . . . 0.0 111.723 165.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -35.86 37.25 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 0.0 112.998 166.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -69.32 -22.02 63.8 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 119.643 -1.91 . . . . 0.0 113.89 173.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -86.69 -5.05 59.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.778 1.231 . . . . 0.0 113.053 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.1 m -102.49 5.49 39.52 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.178 1.791 . . . . 0.0 112.41 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -148.08 4.2 0.72 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.966 1.706 . . . . 0.0 114.436 176.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.7 m -163.42 159.33 22.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 120.02 -1.675 . . . . 0.0 111.387 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.6 t -75.16 67.02 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.488 1.515 . . . . 0.0 110.025 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HB2' HE22 ' A' ' 15' ' ' GLN . 13.3 p -59.37 164.07 3.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.514 1.926 . . . . 0.0 115.17 -164.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -126.68 165.45 19.22 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.43 HD12 ' H ' ' A' ' 13' ' ' LEU . 5.8 mp -60.56 -39.6 88.54 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 -155.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.12 -26.19 64.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.416 HE22 ' HB2' ' A' ' 11' ' ' CYS . 27.3 mt-30 -67.69 -18.21 64.85 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.279 1.032 . . . . 0.0 113.304 175.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.0 mt -88.39 -41.02 13.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.393 1.077 . . . . 0.0 111.058 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -57.27 -43.37 83.03 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.959 0.503 . . . . 0.0 111.302 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.47 5.83 0.37 Allowed 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -131.03 -19.88 2.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.157 1.383 . . . . 0.0 114.391 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.8 t -68.3 143.76 55.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.041 0.837 . . . . 0.0 110.913 168.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.433 ' C ' HD22 ' A' ' 21' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.022 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.481 1.107 0 CA-C-O 116.669 -1.634 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 p -58.09 147.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 118.633 -1.227 . . . . 0.0 107.969 147.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -71.68 -21.89 61.73 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -164.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -143.14 154.54 44.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.869 0.868 . . . . 0.0 112.378 -160.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -77.29 -3.77 41.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.79 2.036 . . . . 0.0 114.02 173.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -80.14 127.96 32.95 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.622 1.169 . . . . 0.0 110.57 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -71.98 141.55 49.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.852 2.461 . . . . 0.0 114.922 -168.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.83 163.93 33.8 Favored Glycine 0 CA--C 1.536 1.345 0 N-CA-C 115.639 1.016 . . . . 0.0 115.639 173.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -7.86 4.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.466 1.506 . . . . 0.0 114.725 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -57.61 -21.68 40.76 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.632 1.573 . . . . 0.0 113.034 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.32 -26.57 46.93 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 172.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -76.81 -37.75 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.203 1.001 . . . . 0.0 110.56 168.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.1 -44.21 91.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.022 0.828 . . . . 0.0 110.708 167.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 -35.72 79.84 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.012 -1.055 . . . . 0.0 113.487 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mt -61.84 -39.1 90.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.836 1.198 . . . . 0.0 112.316 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -67.86 -36.05 79.63 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.312 -0.868 . . . . 0.0 113.178 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.2 -31.65 69.19 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.4 t -81.43 -40.76 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.054 0.942 . . . . 0.0 112.032 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 4.0 t -129.35 -17.42 3.77 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 -159.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.27 -118.27 11.97 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 125.017 1.294 . . . . 0.0 115.337 169.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -64.25 -25.55 68.11 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.857 2.063 . . . . 0.0 114.553 -168.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.404 HH21 ' C ' ' A' ' 21' ' ' ASN . 65.5 mtp180 -57.05 -30.38 64.21 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.584 1.554 . . . . 0.0 115.055 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.6 175.87 24.06 Favored Glycine 0 CA--C 1.54 1.619 0 CA-C-N 118.58 0.627 . . . . 0.0 113.482 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.18 129.93 40.41 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 120.746 -1.443 . . . . 0.0 111.495 -169.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -81.64 -37.33 27.7 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 50.32 86.66 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 47.6 p -72.05 155.31 91.95 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.346 167.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -73.85 136.65 45.73 Favored 'Cis proline' 0 C--N 1.353 0.79 0 CA-C-N 119.37 0.811 . . . . 0.0 112.84 -3.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.09 161.24 22.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.949 1.7 . . . . 0.0 111.117 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 133.584 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.871 0 CA-C-O 118.751 -1.027 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -47.58 -26.11 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 118.016 2.599 . . . . 0.0 118.016 -151.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.38 -18.4 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.494 1.117 . . . . 0.0 113.01 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -55.18 -28.77 55.34 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.32 1.048 . . . . 0.0 113.658 166.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -69.34 -33.27 72.85 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.294 -1.504 . . . . 0.0 112.581 172.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.4 m -68.57 -18.46 64.35 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.221 -0.924 . . . . 0.0 113.329 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -86.12 1.53 50.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.009 2.124 . . . . 0.0 114.147 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -145.14 -11.64 0.55 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -155.06 179.54 9.04 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.432 -1.417 . . . . 0.0 112.057 176.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.32 98.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.911 1.284 . . . . 0.0 111.953 -172.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.5 t -57.97 131.04 49.25 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.377 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.7 m -129.03 140.16 51.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.351 1.46 . . . . 0.0 111.464 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.97 -38.9 79.63 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -155.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -58.93 -22.36 59.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -175.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -62.17 -25.38 67.73 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.919 0.887 . . . . 0.0 113.2 171.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.8 mt -82.02 -39.97 22.77 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.676 1.19 . . . . 0.0 110.939 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.58 -34.42 71.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.841 0.856 . . . . 0.0 111.31 175.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.87 62.68 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.898 1.279 . . . . 0.0 113.145 173.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -118.51 -15.3 9.62 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.689 1.596 . . . . 0.0 115.299 -169.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -64.29 150.63 45.67 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.741 1.155 . . . . 0.0 111.566 166.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 123.006 0.522 . . . . 0.0 112.085 170.162 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.5 t80 . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -64.92 166.04 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 143.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.82 -25.21 61.05 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.43 1.492 . . . . 0.0 114.409 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -133.91 152.25 51.79 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.072 1.349 . . . . 0.0 112.35 -162.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -73.48 25.07 0.07 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.545 1.938 . . . . 0.0 114.798 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.47 113.99 21.16 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.725 -1.235 . . . . 0.0 110.78 -167.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -67.24 129.16 39.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.145 1.778 . . . . 0.0 113.628 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 171.41 -172.54 44.57 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 171.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 49.4 m -58.45 -14.72 8.44 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -58.44 -29.02 65.82 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.006 1.275 . . . . 0.0 112.881 176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.71 -23.15 42.55 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.207 -0.933 . . . . 0.0 113.504 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.9 t -79.15 -36.08 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.252 1.021 . . . . 0.0 110.802 169.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.68 -35.82 82.28 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.07 -1.019 . . . . 0.0 110.982 169.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.83 96.37 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.331 -0.856 . . . . 0.0 112.601 167.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.33 -39.44 79.44 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.009 0.822 . . . . 0.0 112.097 171.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -66.43 -39.45 88.93 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.98 -31.94 64.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.293 1.037 . . . . 0.0 113.003 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 93.2 t -88.09 -40.93 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.064 0.946 . . . . 0.0 111.9 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -143.34 17.05 1.88 Allowed 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -161.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.26 -12.14 36.75 Favored Glycine 0 N--CA 1.474 1.17 0 N-CA-C 118.156 2.023 . . . . 0.0 118.156 -166.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -65.62 -31.02 71.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.943 1.297 . . . . 0.0 113.208 173.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 37.9 mtp180 -102.95 -13.83 16.75 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -160.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 174.91 26.07 Favored Glycine 0 CA--C 1.539 1.576 0 CA-C-N 118.827 0.74 . . . . 0.0 113.229 -166.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -137.35 125.05 22.34 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.13 -1.217 . . . . 0.0 111.038 -170.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -74.92 -44.85 46.33 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -163.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 59.0 142.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.1 p -143.79 158.13 56.93 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 124.682 1.193 . . . . 0.0 111.796 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -68.89 136.03 34.86 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.449 0.839 . . . . 0.0 112.988 -4.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -167.93 163.79 13.82 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.562 2.345 . . . . 0.0 108.093 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.88 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.112 155.131 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.473 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.15 0 CA-C-O 118.26 -1.3 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.51 -19.66 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 N-CA-C 118.189 2.663 . . . . 0.0 118.189 -152.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.93 -21.69 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.852 -1.155 . . . . 0.0 112.705 167.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.473 ' CD ' ' H2 ' ' A' ' 1' ' ' GLY . 2.0 pt-20 -56.41 -31.73 64.16 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.157 -0.965 . . . . 0.0 112.963 169.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -64.54 -46.59 82.19 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.28 -0.888 . . . . 0.0 111.711 169.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.1 m -66.4 -19.78 65.89 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.6 m -83.8 -1.26 53.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.975 1.71 . . . . 0.0 113.874 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.65 -8.44 0.43 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -159.18 177.18 11.34 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.232 -1.543 . . . . 0.0 111.971 -177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.48 96.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.252 1.421 . . . . 0.0 112.725 -166.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.9 t -64.84 127.45 31.61 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.262 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.528 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 75.8 m -130.5 140.94 50.51 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.367 1.467 . . . . 0.0 111.935 -173.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -69.81 -28.54 65.8 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -160.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -60.11 -23.29 63.73 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.724 0.809 . . . . 0.0 113.081 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.528 ' NE2' ' H ' ' A' ' 12' ' ' SER . 26.7 mt-30 -64.57 -22.65 67.03 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.513 -0.742 . . . . 0.0 112.606 173.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.82 -33.8 13.41 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.119 0.872 . . . . 0.0 112.494 -165.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -56.4 -46.15 80.31 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.468 0.652 . . . . 0.0 110.402 162.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -2.65 4.15 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.432 1.493 . . . . 0.0 114.221 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.13 1.71 8.55 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.066 1.747 . . . . 0.0 113.378 176.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.64 -170.0 2.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.51 1.124 . . . . 0.0 112.52 177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 C--O 1.246 0.872 0 C-N-CA 123.491 0.716 . . . . 0.0 109.641 152.807 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . 0.413 ' CG ' ' N ' ' B' ' 2' ' ' VAL . 3.6 t80 . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.413 ' N ' ' CG ' ' B' ' 1' ' ' PHE . 6.2 p -58.33 165.18 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 119.247 0.93 . . . . 0.0 109.096 137.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -70.52 -35.32 73.1 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -168.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pm0 -93.06 142.31 27.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.238 1.015 . . . . 0.0 113.437 -175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -79.82 29.03 0.26 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.708 1.603 . . . . 0.0 112.535 170.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -79.79 109.39 14.16 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.597 -1.314 . . . . 0.0 110.672 -166.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.18 113.82 2.55 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.308 1.043 . . . . 0.0 112.599 -174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.03 -169.11 42.11 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 124.089 0.852 . . . . 0.0 113.181 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 m -58.15 -19.7 34.98 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -173.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -51.88 -29.6 20.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.868 1.213 . . . . 0.0 113.59 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -87.11 -24.11 24.66 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 177.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.7 t -76.22 -42.14 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.417 1.487 . . . . 0.0 110.336 169.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -59.69 -40.07 86.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.618 1.567 . . . . 0.0 111.102 169.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.34 82.36 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.933 -1.104 . . . . 0.0 113.704 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.65 -39.2 88.13 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.421 1.009 . . . . 0.0 112.324 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -61.33 -41.06 96.39 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.276 -0.89 . . . . 0.0 112.063 171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.68 -30.89 68.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -91.82 -29.99 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -142.15 -36.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -167.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 49.02 -97.9 0.02 OUTLIER Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.133 1.349 . . . . 0.0 115.755 164.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -50.81 -36.19 36.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 128.552 2.741 . . . . 0.0 114.007 -171.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -72.33 -22.02 61.23 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -174.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.24 151.75 6.39 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-O 121.786 0.659 . . . . 0.0 113.818 -171.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -96.63 131.76 42.96 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.198 -1.178 . . . . 0.0 111.242 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -84.94 -50.81 7.19 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 118.905 0.775 . . . . 0.0 112.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 56.72 154.17 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -170.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 66.1 p -142.52 154.03 62.87 Favored Pre-proline 0 N--CA 1.475 0.788 0 C-N-CA 124.962 1.305 . . . . 0.0 110.631 167.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.4 158.97 59.06 Favored 'Cis proline' 0 C--N 1.353 0.814 0 N-CA-C 115.548 1.326 . . . . 0.0 115.548 -2.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -164.56 172.2 13.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.639 2.376 . . . . 0.0 107.959 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.343 150.275 . . . . . . . . 0 0 . 1 stop_ save_